MethMarker: user-friendly design and optimization of gene-specific DNA methylation assays (2009)
Schüffler, Peter, Mikeska, Thomas, Waha, Andreas, Lengauer, Thomas, Bock, Christoph
Abstract DNA methylation is a key mechanism of epigenetic regulation that is frequently altered in diseases such as cancer. To confirm the biological or clinical relevance of such changes,...
I. Antes, Ch. Hartmann, Th. Lengauer, Jan H. Meinke, Ipan Mohanty, ...
Proceedings of the NIC Workshop 2008,
1 Structural Descriptors of Protein-Protein Binding Sites (2009)
Oliver S, Francisco S. Domingues, Hongbo Zhu, Thomas Lengauer, Ingolf Sommer
Structural bioinformatics provides new tools for investigating protein-protein interactions at the molecular level. We present two types of structural descriptors for efficiently representing and...
Multi-Task Learning for HIV Therapy Screening (2009)
Steffen Bickel, Jasmina Bogojeska, Thomas Lengauer, Tobias Scheffer
We address the problem of learning classifiers for a large number of tasks. We derive a solution that produces resampling weights which match the pool of all examples to the target distribution of...
EpiGRAPH: user-friendly software for statistical analysis and prediction of (epi)genomic data (2009)
Bock, Christoph, Halachev, Konstantin, Büch, Joachim, Lengauer, Thomas
Abstract The EpiGRAPH web service http://epigraph.mpi-inf.mpg.de/ enables biologists to uncover hidden associations in vertebrate genome and epigenome datasets. Users can upload sets of genomic...
DASMI: exchanging, annotating and assessing molecular interaction data (2009)
Blankenburg, Hagen, Finn, Robert D., Prlic, Andreas, Jenkinson, Andrew M., Ramírez, Fidel, Emig, Dorothea, ...
Motivation: Ever increasing amounts of biological interaction data are being accumulated worldwide, but they are currently not readily accessible to the biologist at a single site. New techniques are...
Abbreviations used: PDB, Protein Data Bank; RMSD, (2008)
Holger Clauûen, Christian Buning, Matthias Rarey, Thomas Lengauer
root-mean-square deviation; CPU, central processing
Abbreviations used: PDB, Protein Data Bank; RMSD, (2008)
Holger Clauûen, Christian Buning, Matthias Rarey, Thomas Lengauer
root-mean-square deviation; CPU, central processing
Protein solubility: sequence based prediction and experimental verification (2008)
Pawel Smialowski, Ra Mikolajka, Tobias Girschick, Tad A. Holak, Dmitrij Frishman, ...
Motivation: Obtaining soluble proteins in sufficient concentrations is a recurring limiting factor in various experimental studies. Solubility is an individual trait of proteins which, under a given...
BIOINFORMATICS Systems Biology (2008)
Mario Albrecht, Carola Huthmacher, Thomas Lengauer
Vol. 21 Suppl. 2 2005, pages ii220–ii221 doi:10.1093/bioinformatics/bti1135 Decomposing protein networks into domain–domain interactions
ProtBuD: A Database of Biological Unit Structures of Protein Families and Superfamilies (2008)
Motivation: Modeling of protein interactions is often possible from known structures of related complexes. It is often time-consuming to find the most appropriate template. Hypothesized biological...
Tetsuya Sato, Yoshihiro Yamanishi, Katsuhisa Horimoto, Hiroyuki Toh, Thomas Lengauer
Partial correlation coefficient between distance matrices
HIV-1 transactivation network (2008)
Mark Griffith A, Tod Courtney A, Jean Peccoud B, William H. S, Ers A, Thomas Lengauer
Dynamic partitioning for hybrid simulation of the bistable
Generation of 3D templates of active sites of proteins with rigid prosthetic groups (2008)
Jean-christophe Nebel, Thomas Lengauer
Motivation: With the increasing availability of protein structures, the generation of biologically meaningful 3D patterns from the simultaneous alignment of several protein structures is an exciting...
Advance Access publication... (2008)
Niko Beerenwinkel, Tobias Sing, Thomas Lengauer, Jörg Rahnenführer, Kirsten Roomp, Igor Savenkov, ...
Received on …; revised on …; accepted on …
Data and text mining ROCR: visualizing classifier performance in R (2008)
Tobias Sing, Oliver S, Niko Beerenwinkel, Thomas Lengauer
Summary: ROCR is a package for evaluating and visualizing the performance of scoring classifiers in the statistical language R. It features over 25 performance measures that can be freely combined to...
Analyzing HIV Resistance Phenomena with bioinformatics Methods (2008)
We report on research taht is targeted towards understanding the resistance phenomena taht HIV undergoes in the presence of selective pressure presented by combination drug therapies. The ultimate...
ABSTRACT Learning Multiple Evolutionary Pathways from Cross-sectional Data (2008)
Niko Beerenwinkel, Jörg Rahnenführer, Martin Däumer, Daniel Hoffmann, Rolf Kaiser, Joachim Selbig, ...
We introduce a mixture model of trees to describe evolutionary processes that are characterized by the accumulation of permanent genetic changes. The basic building block of the model is a directed...
115. The Arby Automated Protein Structure Prediction Server (2008)
Ingolf Sommer, Niklas Von Öhsen, Theo Mevissen, Mario Albrecht, Ralf Zimmer, Thomas Lengauer
Our fully automated protein structure prediction server Arby combines the results of several fold recognition methods to find suitable templates in a database of structural representatives of protein...
in the Drug Discovery Cycle (2008)
In Computer Science, Ralf Hofestädt, Thomas Lengauer, Markus Löffler, Hwa A. Lim, Ph. D
Stability analysis of mixtures of mutagenetic trees (2008)
Bogojeska, Jasmina, Lengauer, Thomas, Rahnenführer, Jörg
Abstract Background Mixture models of mutagenetic trees are evolutionary models that capture several pathways of ordered accumulation of genetic events observed in different subsets of patients. They...
Tobias Sing, Niko Beerenwinkel, Thomas Lengauer, Valentina Svicher, Francesca Ceccherini-silberstein, Carlo-federico Perno
We present a case study on the discovery of clinically relevant domain knowledge in the field of HIV drug resistance. Novel mutations in the HIV genome associated with treatment failure were...
Welsch, Christoph, Domingues, Francisco S, Susser, Simone, Antes, Iris, Hartmann, Christoph, Mayr, Gabriele, ...
Abstract Background The inhibitor telaprevir (VX-950) of the hepatitis C virus (HCV) protease NS3-4A has been tested in a recent phase 1b clinical trial in patients infected with HCV genotype 1. This...
Emig, Dorothea, Cline, Melissa S., Klein, Karsten, Kunert, Anne, Mutzel, Petra, Lengauer, Thomas, ...
Proteins and their interactions are essential for the functioning of all organisms and for understanding biological processes. Alternative splicing is an important molecular mechanism for increasing...
The EuResist approach for predicting response to anti HIV-1 therapy (2008)
Altmann, Andre, Rosen-Zvi, Michal, Prosperi, Mattia, Aharoni, Ehud, Neuvirth, Hani, Schülter, Eugen, ...
Computing topological parameters of biological networks (2008)
Assenov, Yassen, Ramírez, Fidel, Schelhorn, Sven-Eric, Lengauer, Thomas, Albrecht, Mario
Multi-Task Learning for HIV Therapy Screening (2008)
Bickel, Steffen, Bogojeska, Jasmina, Lengauer, Thomas, Scheffer, Tobias
We address the problem of learning classifers for a large number of tasks. We derive a solution that produces resampling weights which match the pool of all examples to the target distribution of any...
Bock, Christoph, Walter, Jörn, Paulsen, Martina, Lengauer, Thomas
Genomic DNA methylation profiles exhibit substantial variation within the human population, with important functional implications for gene regulation. So far little is known about the...
Rtreemix: an R package for estimating evolutionary pathways and genetic progression scores (2008)
Bogojeska, Jasmina, Alexa, Adrian, Altmann, André, Lengauer, Thomas, Rahnenführer, Jörg
Summary: In genetics, many evolutionary pathways can be modeled by the ordered accumulation of permanent changes. Mixture models of mutagenetic trees have been used to describe disease progression in...
Emig, Dorothea, Cline, Melissa S., Klein, Karsten, Kunert, Anne, Mutzel, Petra, Lengauer, Thomas, ...
Integrating expression data with domain interaction networks (2008)
Emig, Dorothea, Cline, Melissa S., Lengauer, Thomas, Albrecht, Mario
Towards Comparative Epigenomics: A Software Toolkit For Cross-Species Epigenome Data Analysis (2008)
Feuerbach, Lars, Christopher, Bock, Halachev, Konstantin, Buech, Joachim, Lengauer, Thomas
Protein-protein interactions: analysis and prediction (2008)
Frishman, Dmitrij, Albrecht, Mario, Blankenburg, Hagen, Bork, Peer, Harrington, Eoghan D., Hermjakob, Henning, ...
Selecting anti-HIV therapies based on a variety of genomic and clinical factors (2008)
Rosen-Zvi, Michal, Altmann, Andre, Prosperi, Mattia, Aharoni, Ehud, Neuvirth, Hani, Sönnerborg, Anders, ...
Rosen-Zvi, Michal, Schülter, Eugen, Altmann, Andre, Sierra-Aragon, Saleta, Zazzi, Maurizio, Sönnerborg, Anders, ...
Structural descriptors of protein-protein binding sites (2008)
Sander, Oliver, Domingues, Francisco S., Zhu, Hongbo, Lengauer, Thomas, Sommer, Ingolf
Genotypic Analysis of HIV Co-Receptor Usage (2008)
Sierra, Saleta, Kaiser, Rolf, Thielen, Alexander, Sander, Oliver, Lengauer, Thomas
Thielen, Alexander, Harrigan, P Richard, Low, Andrew J., Moores, A, Altmann, Andre, Bozek, Kasia, ...
Welsch, Christoph, Domingues, Francisco S., Susser, Simone, Antes, Iris, Hartmann, Christoph, Mayr, Gabriele, ...
Comparison of Classifier Fusion Methods for Predicting Response to Anti HIV-1 Therapy (2008)
Altmann, Andre, Rosen-Zvi, Michal, Prosperi, Mattia, Aharoni, Ehud, Neuvirth, Hani, Sönnerborg, Anders, ...
Stability analysis of mixtures of mutagenetic trees (2008)
Bogojeska, Jasmina, Lengauer, Thomas, Rahnenführer, Jörg
BACKGROUND: Mixture models of mutagenetic trees are evolutionary models that capture several pathways of ordered accumulation of genetic events observed in different subsets of patients. They were...
Local function conservation in sequence and structure space (2008)
Weinhold, Nils, Sander, Oliver, Domingues, Francisco S., Lengauer, Thomas, Sommer, Ingolf
Alignment of Non-Covalent Interactions at Protein-Protein Interfaces (2008)
Zhu, Hongbo, Sommer, Ingolf, Lengauer, Thomas, Domingues, Francisco S.
Background The study and comparison of protein-protein interfaces is essential for the understanding of the mechanisms of interaction between proteins. While there are many methods for comparing...
Applications of semantic similarity measures (2008)
Schlicker, Andreas, Ramírez, Fidel, Rahnenführer, Jörg, Huthmacher, Carola, Pironti, Alejandro, Domingues, Francisco S., ...
There has been much interest in uncovering protein-protein interactions and their underlying domain-domain interactions. Many experimental techniques have been developed, for example yeast-two-hybrid...
Computing topological parameters of biological networks (2008)
Assenov, Yassen, Ramírez, Fidel, Schelhorn, Sven-Eric, Lengauer, Thomas, Albrecht, Mario
Summary: Rapidly increasing amounts of molecular interaction data are being produced by various experimental techniques and computational prediction methods. In order to gain insight into the...
Computational epigenetics (2008)
Bock, Christoph, Lengauer, Thomas
Epigenetic research aims to understand heritable gene regulation that is not directly encoded in the DNA sequence. Epigenetic mechanisms such as DNA methylation and histone modifications modulate the...
Bock, Christoph, Walter, Jörn, Paulsen, Martina, Lengauer, Thomas
Genomic DNA methylation profiles exhibit substantial variation within the human population, with important functional implications for gene regulation. So far little is known about the...
Integrating expression data with domain interaction networks (2008)
Emig, Dorothea, Cline, Melissa S., Lengauer, Thomas, Albrecht, Mario
Summary: Recent studies have revealed that alternative splicing plays an important role in the observed protein and interaction diversity. Special microarrays allow for measuring gene expression at...
Rtreemix: an R package for estimating evolutionary pathways and genetic progression scores (2008)
Bogojeska, Jasmina, Alexa, Adrian, Altmann, André, Lengauer, Thomas, Rahnenführer, Jörg
Summary: In genetics, many evolutionary pathways can be modeled by the ordered accumulation of permanent changes. Mixture models of mutagenetic trees have been used to describe disease progression in...
Selecting anti-HIV therapies based on a variety of genomic and clinical factors (2008)
Rosen-Zvi, Michal, Altmann, Andre, Prosperi, Mattia, Aharoni, Ehud, Neuvirth, Hani, Sönnerborg, Anders, ...
Motivation: Optimizing HIV therapies is crucial since the virus rapidly develops mutations to evade drug pressure. Recent studies have shown that genotypic information might not be sufficient for the...
Herausgegeben von / Edited by: (2007)
Hans-ludwig Hausen, Dieter Welzel, Dieter Welzel, Peter Behr, Raul Camposano, Thomas Christaller, ...
Materialien. Im Interesse einer spateren Veroffentlichung wird gebeten, die Arbeitspapiere nicht weiter zu vervielfaltigen. Die Autoren sind fur kritische Hinweise dankbar. The...
Time-Efficient Docking of Similar Flexible Ligands (2007)
Matthias Rarey, Bernd Kramer, Christoph Bernd, Thomas Lengauer
i is joined to all placements found so far among all possible conformations of a finite energetically favorable set. The model of conformational flexibility of the ligand is equal to that of the...
`Go with the winners' Generators with Applications to Molecular Modeling (2007)
Marcus Peinado, Thomas Lengauer
. A generation problem is the problem of generating an element of a (usually exponentially large) set under a given distribution. We develop a method for the design of generation algorithms which is...
Confidence Measures for Fold Recognition (2007)
Ingolf Sommer, Niklas Von Ohsen, Er Zien, Ralf Zimmer, Thomas Lengauer
It is a standard procedure to compare new amino acid sequences to databases of proteins that have been studied already in order to find similarities in structure and function.
Alexander Zien, Juliane Fluck, Ralf Zimmer, Thomas Lengauer
yx We estimate the number of microarrays that is required in order to gain reliable results from a common type of study: the pairwise comparison of different classes of samples. Current knowlegde...
Svicher, Valentina, Sing, Tobias, Artese, Anna, Santoro, Maria Mercedes, Forbici, Federica, ...
Resistance to antivirals is a complex and dynamic phenomenon that involves more mutations than are currently known. Here, we characterize 10 additional mutations (L74V, K101Q, I135M/T, V179I, H221Y,...
Hartmann, Christoph, Antes, Iris, Lengauer, Thomas
We introduce a new algorithm, IRECS (Iterative REduction of Conformational Space), for identifying ensembles of most probable side-chain conformations for homology modeling. On the basis of a given...
Flockerzi, Aline, Maydt, Jochen, Frank, Oliver, Ruggieri, Alessia, Maldener, Esther, Seifarth, Wolfgang, ...
Abstract Background The human genome comprises numerous human endogenous retroviruses (HERVs) that formed millions of years ago in ancestral species. A number of loci of the HERV-K(HML-2) family are...
CpG Island Mapping by Epigenome Prediction (2007)
Christoph Bock, Jörn Walter, Martina Paulsen, Thomas Lengauer
CpG islands were originally identified by epigenetic and functional properties, namely, absence of DNA methylation and frequent promoter association. However, this concept was quickly replaced by...
CpG island mapping by epigenome prediction (2007)
Christoph Bock, Jorn E Walter, Martina Paulsen, Thomas Lengauer
CpG islands were originally identified by epigenetic and functional properties, namely absence of DNA methylation and frequent promoter association. However, this concept was quickly replaced by...
Functional evaluation of domain-domain interactions and human protein interaction networks (2007)
Schlicker, Andreas, Huthmacher, Carola, Ramírez, Fidel, Lengauer, Thomas, Albrecht, Mario
Motivation: Large amounts of protein and domain interaction data are being produced by experimental high-throughput techniques and computational approaches. To gain insight into the value of the...
GOTax: investigating biological processes and biochemical activities along the taxonomic tree (2007)
Schlicker, Andreas, Rahnenführer, Jörg, Albrecht, Mario, Lengauer, Thomas, Domingues, Francisco S
Abstract We describe GOTax, a comparative genomics platform that integrates protein annotation with protein family classification and taxonomy. User-defined sets of proteins, protein families,...
GOTax: investigating biological processes and biochemical activities along the taxonomic tree (2007)
Schlicker, Andreas, Rahnenführer, Jörg, Albrecht, Mario, Lengauer, Thomas, Domingues, Francisco S
Abstract We describe GOTax, a comparative genomics platform that integrates protein annotation with protein family classification and taxonomy. User-defined sets of proteins, protein families,...
Structural Descriptors of gp120 V3 Loop for the Prediction of HIV-1 Coreceptor Usage (2007)
Oliver Sander, Tobias Sing, Ingolf Sommer, Andrew J. Low, Peter K. Cheung, P. Richard Harrigan, ...
HIV-1 cell entry commonly uses, in addition to CD4, one of the chemokine receptors CCR5 or CXCR4 as coreceptor. Knowledge of coreceptor usage is critical for monitoring disease progression as well as...
Schulz, Wolfgang A, Alexa, Adrian, Jung, Volker, Hader, Christiane, Hoffmann, Michèle J, Yamanaka, Masanori, ...
Abstract Background Alterations of chromosome 8 and hypomethylation of LINE-1 retrotransposons are common alterations in advanced prostate carcinoma. In a former study including many metastatic...
Structural Descriptors of gp120 V3 Loop for the Prediction of HIV-1 Coreceptor Usage (2007)
Oliver Sander, Tobias Sing, Ingolf Sommer, Andrew J Low, Peter K Cheung, P Richard Harrigan, ...
HIV-1 cell entry commonly uses, in addition to CD4, one of the chemokine receptors CCR5 or CXCR4 as coreceptor. Knowledge of coreceptor usage is critical for monitoring disease progression as well as...
Christoph Bock, Thomas Lengauer
Epigenetic research aims to understand heritable gene regulation that is not directly encoded in the DNA sequence. Epigenetic mechanisms such as DNA methylation and histone modifications modulate the...
2007 Schlicker et Volume al. 8, Issue 3, Article R33 Open Access (2007)
Andreas Schlicker, Jörg Rahnenführer, Mario Albrecht, Thomas Lengauer, Francisco S Domingues
Software GOTax: investigating biological processes and biochemical activities along the taxonomic tree
Genome Analysis Computational Epigenetics (2007)
Christoph Bock, Thomas Lengauer
Epigenetic research aims to understand heritable gene regulation that is not directly encoded in the DNA sequence. Epigenetic mechanisms such as DNA methylation and histone modifications modulate the...
der Naturwissenschaftlich-Technischen Fakultät III (2007)
Dekan Prof, Dr. Uli Müller, Berichterstatter Prof, Dr. Volkhard Helms, ...
2
Conformational analysis of alternative protein structures (2007)
Domingues, Francisco S., Rahnenführer, Jörg, Lengauer, Thomas
Structural and functional comparison of the non-structural protein 4B of Flaviviridae (2007)
Steffen, Andreas, Thiele, C., Tietze, S., Strassnig, C., Kämper, A., Lengauer, Thomas, ...
Bioinformatics prediction of HIV coreceptor usage (2007)
Lengauer, Thomas, Sander, Oliver, Sierra, Saleta, Thielen, Alexander, Kaiser, Rolf
Identification of PatL1, a human homolog to yeast P body component Pat1 (2007)
Scheller, Nicoletta, Resa-Infante, Patricia, De La Luna, Susana, Galao, Rui Pedro, Albrecht, Mario, Kaestner, Lars, ...
Ahlenstiel, Golo, Roomp, Kirsten, Däumer, Martin, Nattermann, Jacob, Vogel, Martin, Rockstroh, Jürgen K., ...
Improved cyclodextrin-based receptors for camptothecin by inverse virtual screening (2007)
Steffen, Andreas, Thiele, Carolin, Tietze, Simon, Strassnig, Christian, Kämper, Andreas, Lengauer, Thomas, ...
Combined similarity and QSPR virtual screening for guest molecules of ß-cyclodextrin (2007)
Steffen, Andreas, Karasz, Maximilian, Thiele, Carolin, Lengauer, Thomas, Kämper, Andreas, Wenz, Gerhard, ...
Moment invariants as shape recognition technique for comparing protein binding sites (2007)
Sommer, Ingolf, Müller, Oliver, Domingues, Francisco S., Sander, Oliver, Weickert, Joachim, Lengauer, Thomas
Ketter, Ralf, Urbschat, Steffi, Henn, Wolfram, Feiden, Wolfgang, Beerenwinkel, Niko, Lengauer, Thomas, ...
Predicting HIV coreceptor usage on the basis of genetic and clinical covariates (2007)
Sing, Tobias, Low, Andrew J., Beerenwinkel, Niko, Sander, Oliver, Cheung, Peter K., Domingues, Francisco S., ...
Welker, Martin W., Hofmann, Wolf-Peter, Welsch, Christoph, Von Wagner, Michael, Herrmann, Eva, Lengauer, Thomas, ...
Functional evaluation of domain–domain interactions and human protein interaction networks (2007)
Schlicker, Andreas, Huthmacher, Carola, Ramírez, Fidel, Lengauer, Thomas, Albrecht, Mario
Motivation: Large amounts of protein and domain interaction data are being produced by experimental high-throughput techniques and computational approaches. To gain insight into the value of the...
Structural Descriptors of gp120 V3 Loop for the Prediction of {HIV-1} Coreceptor Usage (2007)
Sander, Oliver, Sing, Tobias, Sommer, Ingolf, Low, Andrew J., Cheung, Peter K., Harrigan, P. Richard, ...
HIV-1 cell entry commonly uses, in addition to CD4, one of the chemokine receptors CCR5 or CXCR4 as coreceptor. Knowledge of coreceptor usage is critical for monitoring disease progression as well as...
Computational analysis of human protein interaction networks (2007)
Ramírez, Fidel, Schlicker, Andreas, Assenov, Yassen, Lengauer, Thomas, Albrecht, Mario
Structural and functional comparison of the non-structural protein 4B in flaviviridae (2007)
Welsch, Christoph, Albrecht, Mario, Maydt, Jochen, Herrmann, Eva, Welker, Martin W., Sarrazin, Christoph, ...
Schulz, Wolfgang A., Alexa, Adrian, Jung, Volker, Hader, Christiane, Hoffmann, Michele J., Yamanaka, Masanori, ...
Background Alterations of chromosome 8 and hypomethylation of LINE-1 retrotransposons are common alterations in advanced prostate carcinoma. In a former study including many metastatic cases, they...
Flockerzi, Aline, Maydt, Jochen, Frank, Oliver, Ruggieri, Alessia, Maldener, Esther, Seifarth, Wolfgang, ...
Ceccherini-Silberstein, Francesca, Svicher, Valentina, Sing, Tobias, Artese, Anna, Santoro, Maria Mercedes, Forbici, Federica, ...
Resistance to antivirals is a complex and dynamic phenomenon that involves more mutations than are currently known. Here, we characterize 10 additional mutations (L74V, K101Q, I135M/T, V179I, H221Y,...
Hampe, Jochen, Franke, Andre, Rosenstiel, Philip, Till, Andreas, Teuber, Markus, Huse, Klaus, ...
We performed a genome-wide association study of 19,779 nonsynonymous SNPs in 735 individuals with Crohn disease and 368 controls. A total of 7,159 of these SNPs were informative. We followed up on...
Genotypic coreceptor analysis (2007)
Sierra, Saleta, Kaiser, Rolf, Thielen, Alexander, Lengauer, Thomas
HIV infects target cells by binding of its envelope gp120 protein to CD4 and a coreceptor on the cell surface. In vivo, the different HIV-strains use either CCR5 or CXCR4 as coreceptor. CCR5-using...
CpG Island Mapping by Epigenome Prediction (2007)
Bock, Christoph, Walter, Jörn, Paulsen, Martina, Lengauer, Thomas
Hartmann, Christoph, Antes, Iris, Lengauer, Thomas
We introduce a new algorithm, IRECS (Iterative REduction of Conformational Space), for identifying ensembles of most probable side-chain conformations for homology modeling. On the basis of a given...
Altmann, Andre, Beerenwinkel, Niko, Sing, Tobias, Savenkov, Igor, Däumer, Martin, Kaiser, Rolf, ...
Background: The outcome of antiretroviral combination therapy depends on many factors involving host, virus, and drugs. We investigate prediction of treatment response from the applied drug...
GOTax: investigating biological processes and biochemical activities along the taxonomic tree (2007)
Schlicker, Andreas, Rahnenführer, Jörg, Albrecht, Mario, Lengauer, Thomas, Domingues, Francisco S.
We describe GOTax (http://gotax.bioinf.mpi-inf.mpg.de/), a comparative genomics platform that integrates protein annotation with protein family classification and taxonomy. User-defined sets of...
The implications of alternative splicing in the ENCODE protein complement (2007)
Tress, Michael L., Martelli, Pier L., Frankish, Adam, Reeves, Gabrielle A., Wesselink, Jan J., Yeats, Corin, ...
Alternative premessenger RNA splicing enables genes to generate more than one gene product. Splicing events that occur within protein coding regions have the potential to alter the biological...
Conformational analysis of alternative protein structures (2007)
Domingues, Francisco S., Rahnenführer, Jörg, Lengauer, Thomas
Motivation: Alternative structural models determined experimentally are available for an increasing number of proteins. Structural and functional studies of these proteins need to take these models...
Moment invariants as shape recognition technique for comparing protein binding sites (2007)
Sommer, Ingolf, Müller, Oliver, Domingues, Francisco S., Sander, Oliver, Weickert, Joachim, Lengauer, Thomas
Motivation: An approach for identifying similarities of protein–protein binding sites is presented. The geometric shape of a binding site is described by computing a feature vector based on moment...
Improving the quality of protein structure models by selecting from alignment alternatives (2006)
Sommer, Ingolf, Toppo, Stefano, Sander, Oliver, Lengauer, Thomas, Tosatto, Silvio CE
Abstract Background In the area of protein structure prediction, recently a lot of effort has gone into the development of Model Quality Assessment Programs (MQAPs). MQAPs distinguish high quality...
Model Selection for Mixtures of Mutagenetic Trees (2006)
Yin, Junming, Beerenwinkel, Niko, Rahnenführer, Jörg, Lengauer, Thomas
The evolution of drug resistance in HIV is characterized by the accumulation of resistance-associated mutations in the HIV genome. Mutagenetic trees, a family of restricted Bayesian tree models, have...
Model Selection for Mixtures of Mutagenetic Trees (2006)
Yin, Junming, Beerenwinkel, Niko, Rahnenführer, Jörg, Lengauer, Thomas
The evolution of drug resistance in HIV is characterized by the accumulation of resistance-associated mutations in the HIV genome. Mutagenetic trees, a family of restricted Bayesian tree models, have...
Model Selection for Mixtures of Mutagenetic Trees (2006)
Yin, Junming, Beerenwinkel, Niko, Rahnenführer, Jörg, Lengauer, Thomas
The evolution of drug resistance in HIV is characterized by the accumulation of resistance-associated mutations in the HIV genome. Mutagenetic trees, a family of restricted Bayesian tree models, have...
Model Selection for Mixtures of Mutagenetic Trees (2006)
Yin, Junming, Beerenwinkel, Niko, Rahnenführer, Jörg, Lengauer, Thomas
The evolution of drug resistance in HIV is characterized by the accumulation of resistance-associated mutations in the HIV genome. Mutagenetic trees, a family of restricted Bayesian tree models, have...
A new measure for functional similarity of gene products based on Gene Ontology (2006)
Schlicker, Andreas, Domingues, Francisco S, Rahnenführer, Jörg, Lengauer, Thomas
Abstract Background Gene Ontology (GO) is a standard vocabulary of functional terms and allows for coherent annotation of gene products. These annotations provide a basis for new methods that compare...
Christoph Bock, Martina Paulsen, Sascha Tierling, Thomas Mikeska, Thomas Lengauer, Jörn Walter
CpG island methylation plays an important role in epigenetic gene control during mammalian development and is frequently altered in disease situations such as cancer. The majority of CpG islands is...
NOXclass: prediction of protein-protein interaction types (2006)
Zhu, Hongbo, Domingues, Francisco S, Sommer, Lngolf, Lengauer, Thomas
Abstract Background Structural models determined by X-ray crystallography play a central role in understanding protein-protein interactions at the molecular level. Interpretation of these models...
Local protein structure prediction using discriminative models (2006)
Sander, Oliver, Sommer, Ingolf, Lengauer, Thomas
Abstract Background In recent years protein structure prediction methods using local structure information have shown promising improvements. The quality of new fold predictions has risen...
Christoph Bock, Martina Paulsen, Sascha Tierling, Thomas Mikeska, Thomas Lengauer, Jorn E Walter
CpG island methylation plays an important role in epigenetic gene control during mammalian development and is frequently altered in disease situations such as cancer. The majority of CpG islands is...
Computational recognition of potassium channel sequences (2006)
Burkhard Heil, Jost Ludwig, Hella Lichtenberg-fraté, Thomas Lengauer
doi:10.1093/bioinformatics/btl132
GCB2005 Thermodynamics of RNA-RNA Binding (2006)
Ulrike Mückstein A, Hakim Tafer A, Jörg Hackermüller B, ...
Background: Reliable predictions of RNA-RNA binding energies is crucial e.g. for the understanding on RNAi, microRNA-mRNA binding, and antisense interactions. The thermodynamics of such RNA-RNA...
Development and validation of a consistency based multiple structure alignment algorithm (2006)
Jessica Ebert, Douglas Brutlag, Thomas Lengauer
*To whom correspondence should be addressed Summary: We introduce an algorithm that uses the information gained from simultaneous consideration of an entire group of related proteins to create...
Oliver S, Ingolf Sommer, Thomas Lengauer
Background: In recent years protein structure prediction methods using local structure information have shown promising improvements. The quality of new fold predictions has risen significantly and...
BIOINFORMATICS Family specific rates of protein evolution (2006)
Hannes Luz, Martin Vingron, Thomas Lengauer
Motivation: Amino acid changing mutations in proteins are contstrained by purifying selection and accumulate at different rates. We estimate evolutionary rates on multiple alignments of eukaryotic...
Planning optimal measurements of isotopomer distributions for estimation of metabolic fluxes (2006)
Ari Rantanen, Taneli Mielikäinen, Juho Rousu, Hannu Maaheimo, Thomas Lengauer
Motivation: Flux estimation using isotopomer information of metabolites is currently the most reliable method to obtain quantitative estimates of the activity of metabolic pathways. However, the...
Bioinformatisches Data Mining erschließt neue Strategien gegen Krebs (2006)
Bock, Christoph, Halachev, Konstantin, Lengauer, Thomas, Haasis, Klaus, Heinzl, Armin, Klumpp, Dieter
Development of Computational Methods for Analysis of Metabolic Profiling Data (2006)
Talwar, Priti, Lengauer, Thomas, Wittmann, Christoph, Velagapudi, VR, Heinzle, Elmar
Stable coreceptor usage of HIV in patients with ongoing treatment failure on {HAART} (2006)
Lehmann, Clara, Däumer, Martin, Bousaad, Ibrahim, Sing, Tobias, Beerenwinkel, Niko, Lengauer, Thomas, ...
Background Disease progression in HIV infection has been associated with switch of viral coreceptor usage from CCR5 to CXCR4. Objectives To investigate the relationship between HIV-coreceptor tropism...
Improving the quality of protein structure models by selecting from alignment alternatives (2006)
Sommer, Ingolf, Toppo, Stefano, Sander, Oliver, Lengauer, Thomas, Tosatto, Silvio
Background In the area of protein structure prediction, recently a lot of effort has gone into the development of Model Quality Assessment Programs (MQAPs). MQAPs distinguish high quality protein...
Computational recognition of potassium channel sequences (2006)
Heil, Burkhard, Ludwig, Jost, Lichtenberg-Fraté, Hella, Lengauer, Thomas
Motivation: Potassium channels are mainly known for their role in regulating and maintaining the membrane potential. Since this is one of the key mechanisms of signal transduction, malfunction of...
Mutations in the NB-ARC domain of {I-2} that impair {ATP} hydrolysis cause autoactivation (2006)
Tameling, Wladimir I., Vossen, Jack H., Albrecht, Mario, Lengauer, Thomas, Berden, Jan A., Haring, Michel A., ...
Resistance (R) proteins in plants confer specificity to the innate immune system. Most R proteins have a centrally located NB-ARC (nucleotide-binding adaptor shared by APAF-1, R proteins, and CED-4)...
Arevir: A Secure Platform for Designing Personalized Antiretroviral Therapies Against HIV (2006)
Roomp, Kirsten, Beerenwinkel, Niko, Sing, Tobias, Schülter, Eugen, Büch, Joachim, Sierra-Aragon, Saleta, ...
Despite the availability of antiretroviral combination therapies, success in drug treatment of HIV-infected patients is limited. One reason for therapy failure is the development of drug-resistant...
Steffen, Andreas, Kämper, Andreas, Lengauer, Thomas
We present a new algorithm for the fast and reliable structure prediction of synthetic receptor-ligand complexes. Our method is based on the protein-ligand docking program FlexX and extends our...
Kämper, Andreas, Apostolakis, Joannis, Rarey, Matthias, Marian, Christel M., Lengauer, Thomas
The prediction of the structure of host-guest complexes is one of the most challenging problems in supramolecular chemistry. Usual procedures for docking of ligands into receptors do not take full...
A new measure for functional similarity of gene products based on Gene Ontology (2006)
Schlicker, Andreas, Domingues, Francisco S., Rahnenführer, Jörg, Lengauer, Thomas
\paragraph*{Background:} Gene Ontology (GO) is a standard vocabulary of functional terms and allows for coherent annotation of gene products. These annotations provide a basis for new methods that...
Functional evaluation of domain-domain interactions and human protein interaction networks (2006)
Schlicker, Andreas, Huthmacher, Carola, Ramírez, Fidel, Lengauer, Thomas, Albrecht, Mario, Huson, Daniel, ...
Large amounts of protein and domain interaction data are being produced by experimental high-throughput techniques and computational approaches. To gain insight into the value of the provided data,...
Local protein structure prediction using discriminative models (2006)
Sander, Oliver, Sommer, Ingolf, Lengauer, Thomas
Background In recent years protein structure prediction methods using local structure information have shown promising improvements. The quality of new fold predictions has risen significantly and in...
Bioinformatics-assisted anti-HIV therapy (2006)
Lengauer, Thomas, Sing, Tobias
Highly active antiretroviral therapy (HAART), in which three or more drugs are given in combination, has substantially improved the clinical management of HIV-1 infection. Still, the emergence of...
NOXclass: prediction of protein-protein interaction types (2006)
Zhu, Hongbo, Domingues, Francisco S., Sommer, Ingolf, Lengauer, Thomas
Background Structural models determined by X-ray crystallography play a central role in understanding protein-protein interactions at the molecular level. Interpretation of these models requires the...
A Fully Computational Model for Predicting Percutaneous Drug Absorption (2006)
Neumann, Dirk, Kohlbacher, Oliver, Merkwirth, Christian, Lengauer, Thomas
The prediction of transdermal absorption for arbitrary penetrant structures has several important applications in the pharmaceutical industry. We propose a new data-driven, predictive model for skin...
Virtual screening for guest molecules of a biosensor (2006)
Steffen, Andreas, Kämper, Andreas, Lengauer, Thomas, Turner, Anthony P. F.
Bock, Christoph, Paulsen, Martina, Tierling, Sascha, Mikeska, Thomas, Lengauer, Thomas, Walter, Jörn
CpG island methylation plays an important role in epigenetic gene control during mammalian development and is frequently altered in disease situations such as cancer. The majority of CpG islands is...
Recco: recombination analysis using cost optimization (2006)
Maydt, Jochen, Lengauer, Thomas
Motivation: Recombination plays an important role in the evolution of many pathogens, such as HIV or malaria. Despite substantial prior work, there is still a pressing need for efficient and...
Model Selection for Mixtures of Mutagenetic Trees (2006)
Yin, Junming, Beerenwinkel, Niko, Rahnenführer, Jörg, Lengauer, Thomas
The evolution of drug resistance in HIV is characterized by the accumulation of resistance-associated mutations in the HIV genome. Mutagenetic trees, a family of restricted Bayesian tree models, have...
Mutations in the MutSalpha interaction interface of {MLH1} can abolish {DNA} mismatch repair (2006)
Plotz, Guido, Welsch, Christoph, Giron-Monzon, Luis, Friedhoff, Peter, Albrecht, Mario, Piiper, Albrecht, ...
MutL, a heterodimer of MLH1 and PMS2, plays a central role in human DNA mismatch repair. It interacts ATP-dependently with the mismatch detector MutS and assembles and controls further repair...
Mihm, Ulrike, Grigorian, Natalia, Welsch, Christoph, Herrmann, Eva, Kronenberger, Bernd, Teuber, Gerlinde, ...
Antes, Iris, Siu, Weng-In, Lengauer, Thomas
Motivation: The binding of endogenous antigenic peptides to MHC class I molecules is an important step during the immunologic response of a host against a pathogen. Thus, various sequence- and...
Alexa, Adrian, Rahnenführer, Jörg, Lengauer, Thomas
\begin{abstract} \section{Motivation:} The result of a typical microarray experiment is a long list of genes with corresponding expression measurements. This list is only the starting point for a...
Improving the quality of protein structure models by selecting from alignment alternatives (2006)
Sommer, Ingolf, Toppo, Stefano, Sander, Olivier, Lengauer, Thomas, Tosatto, Silvio CE
Background In the area of protein structure prediction, recently a lot of effort has gone into the development of Model Quality Assessment Programs (MQAPs). MQAPs distinguish high quality protein...
Computational recognition of potassium channel sequences (2006)
Heil, Burkhard, Ludwig, Jost, Lichtenberg-Fraté, Hella, Lengauer, Thomas
Motivation: Potassium channels are mainly known for their role in regulating and maintaining the membrane potential. Since this is one of the key mechanisms of signal transduction, malfunction of...
Alexa, Adrian, Rahnenführer, Jörg, Lengauer, Thomas
Motivation: The result of a typical microarray experiment is a long list of genes with corresponding expression measurements. This list is only the starting point for a meaningful biological...
Recco: recombination analysis using cost optimization (2006)
Maydt, Jochen, Lengauer, Thomas
Motivation: Recombination plays an important role in the evolution of many pathogens, such as HIV or malaria. Despite substantial prior work, there is still a pressing need for efficient and...
Antes, Iris, Siu, Shirley W. I., Lengauer, Thomas
Motivation: The binding of endogenous antigenic peptides to MHC class I molecules is an important step during the immunologic response of a host against a pathogen. Thus, various sequence- and...
Dissection of the Inflammatory Bowel Disease Transcriptome Using Genome-Wide cDNA Microarrays (2005)
Christine M. Costello, Nancy Mah, Robert Häsler, Philip Rosenstiel, Georg H. Waetzig, Andreas Hahn, ...
cDNA analysis of colonic samples from patients with Crohn disease and ulcerative colitis suggests substantial differences in pathophysiology between the two diseases.
Dissection of the Inflammatory Bowel Disease Transcriptome Using Genome-Wide cDNA Microarrays (2005)
Christine M. Costello, Nancy Mah, Robert Häsler, Philip Rosenstiel, Georg H. Waetzig, Andreas Hahn, ...
Background The differential pathophysiologic mechanisms that trigger and maintain the two forms of inflammatory bowel disease (IBD), Crohn disease (CD), and ulcerative colitis (UC) are only partially...
Confirmation of human protein interaction data by human expression data (2005)
Hahn, Andreas, Rahnenführer, Jörg, Talwar, Priti, Lengauer, Thomas
Abstract Background With microarray technology the expression of thousands of genes can be measured simultaneously. It is well known that the expression levels of genes of interacting proteins are...
Dissection of the inflammatory bowel disease transcriptome using genome-wide cDNA microarrays (2005)
Costello, Christine M., Mah, Nancy, Häsler, Robert, Rosenstiel, Philip, Waetzig, Georg H., Hahn, Andreas, ...
Background The differential pathophysiologic mechanisms that trigger and maintain the two forms of inflammatory bowel disease (IBD), Crohn disease (CD), and ulcerative colitis (UC) are only partially...
An integrative approach to gain insights into the cellular function of human ataxin-2 (2005)
Ralser, Markus, Albrecht, Mario, Nonhoff, Ute, Lengauer, Thomas, Lehrach, Hans, Krobitsch, Sylvia
Spinocerebellar ataxia type 2 (SCA2) is a hereditary neurodegenerative disorder caused by a trinucleotide expansion in the SCA2 gene, encoding a polyglutamine stretch in the gene product ataxin-2...
Ralser, Markus, Nonhoff, Ute, Albrecht, Mario, Lengauer, Thomas, Wanker, Erich E., Lehrach, Hans, ...
Spinocerebellar ataxia type 2 is an inherited neurodegenerative disorder that is caused by an expanded trinucleotide repeat in the SCA2 gene, encoding a polyglutamine stretch in the gene product...
Niko Beerenwinkel, Tobias Sing, Thomas Lengauer, Jörg Rahnenführer, Kirsten Roomp, Igor Savenkov, ...
Data and text mining Vol. 21 no. 21 2005, pages 3943–3950 doi:10.1093/bioinformatics/bti654 Computational methods for the design of effective therapies against drug resistant HIV strains
Christoph Bock, Sabine Reither, Thomas Mikeska, Martina Paulsen, Jörn Walter, Thomas Lengauer
Summary: Manual processing of DNA methylation data from bisulfite sequencing is a tedious and error-prone task. Here we present an interactivesoftwaretool that providesstart-to-endsupportfor...
Lengauer T: Recco: Recombination analysis using cost optimization (2005)
Jochen Maydt, Thomas Lengauer, Martin Bishop
Motivation: Recombination plays an important role in the evolution of many pathogens, such as HIV or malaria. Despite substantial prior work, there is still a pressing need for efficient and...
Lengauer T: Recco: Recombination analysis using cost optimization (2005)
Motivation: Recombination plays an important role in the evolution of many pathogens, such as HIVor malaria. Despite substantial prior work, there is still a pressing need for efficient and effective...
Wemmert, Silke, Ketter, Ralf, Rahnenführer, Jörg, Beerenwinkel, Niko, Strowitzki, Martin, Feiden, Wolfgang, ...
A new CARD15 mutation in Blau syndrome (2005)
Van Duist, Marjan M., Albrecht, Mario, Podswiadek, Marta, Giachino, Daniela, Lengauer, Thomas, Punzi, Leonardo, ...
Sarcoidosis is associated with a truncating splice site mutation in BTNL2 (2005)
Valentonyte, Ruta, Hampe, Jochen, Huse, Klaus, Rosenstiel, Philip, Albrecht, Mario, Stenzel, Annette, ...
Ulmschneider, Sarah, Mueller-Vieira, Ursula, Mitrenga, Markus, Hartmann, Rolf W., Oberwinkler-Marchais, S, Klein, Christian D., ...
Ulmschneider, Sarah, Mueller-Vieira, Ursula, Klein, Christian D., Antes, Iris, Lengauer, Thomas, Hartmann, Rolf W.
FlexR - A new tool for predicting the structure of synthetic host-guest complexes (2005)
Steffen, Andreas, Kämper, Andreas, Lengauer, Thomas, Turner, A.P.F.
Sarrazin, Christoph, Mihm, Ulrike, Herrmann, Eva, Welsch, Christoph, Albrecht, Mario, Sarrazin, Ulrike, ...
Ralser, Markus, Nonhoff, Ute, Albrecht, Mario, Lengauer, Thomas, Wanker, Erich E., Lehrach, Hans, ...
An integrative approach to gain insights into the cellular function of human ataxin-2 (2005)
Ralser, Markus, Albrecht, Mario, Nonhoff, Ute, Lengauer, Thomas, Lehrach, Hans, Krobitsch, Sylvia
Estimating cancer survival and clinical outcome based on genetic tumor progression scores (2005)
Rahnenführer, Jörg, Beerenwinkel, Niko, Schulz, Wolfgang A., Hartmann, Christian, Von Deimling, Andreas, Wullich, Bernd, ...
Bock, Christoph, Lengauer, Thomas, Reither, Sabine, Mikeska, Thomas, Paulsen, Martina, Walter, Jörn
SUMMARY: Manual processing of DNA methylation data from bisulfite sequencing is a tedious and error-prone task. Here we present an interactive software tool that provides start-to-end support for...
Beerenwinkel, Niko, Sing, Tobias, Lengauer, Thomas, Rahnenführer, Jörg, Roomp, Kirsten, Savenkov, Igor, ...
Mtreemix: a software package for learning and using mixture models of mutagenetic trees (2005)
Beerenwinkel, Niko, Rahnenführer, Jörg, Kaiser, Rolf, Hoffmann, Daniel, Selbig, Joachim, Lengauer, Thomas
Learning multiple evolutionary pathways from cross-sectional data (2005)
Beerenwinkel, Niko, Rahnenführer, Jörg, Däumer, Martin, Hoffmann, Daniel, Kaiser, Rolf, Selbig, Joachim, ...
Estimating HIV evolutionary pathways and the genetic barrier to drug resistance (2005)
Beerenwinkel, Niko, Däumer, Martin, Sing, Tobias, Rahnenführer, Jörg, Lengauer, Thomas, Selbig, Joachim, ...
Decomposing protein networks into domain-domain interactions (2005)
Albrecht, Mario, Huthmacher, Carola, Tosatto, Silvio C.E., Lengauer, Thomas
Multiple-Ligand-Based Virtual Screening: Methods and Applications of the MTree Approach (2005)
Hessler, G., Zimmermann, M., Matter, H., Evers, A., Naumann, T., Lengauer, Thomas, ...
Confirmation of human protein interaction data by human expression data (2005)
Hahn, Andreas, Rahnenführer, Jörg, Talwar, Priti, Lengauer, Thomas
Costello, Christine M., Mah, Nancy, Häsler, Robert, Rosenstiel, Philip, Waetzig, Georg H., Hahn, Andreas, ...
Castellano, Sergi, Lobanov, Alexey V., Chapple, Charles, Novoselov, Sergey V., Albrecht, Mario, Hua, Deame, ...
ROCR: visualizing classifier performance in R (2005)
Sing, Tobias, Sander, Oliver, Beerenwinkel, Niko, Lengauer, Thomas
Summary: ROCR is a package for evaluating and visualizing the performance of scoring classifiers in the statistical language R. It features over 25 performance measures that can be freely combined to...
Decomposing protein networks into domain-domain interactions (2005)
Albrecht, Mario, Huthmacher, Carola, Tosatto, Silvio C. E., Lengauer, Thomas
Summary: The application of novel experimental techniques has generated large networks of protein–protein interactions. Frequently, important information on the structure and cellular function of...
Ralser, Markus, Nonhoff, Ute, Albrecht, Mario, Lengauer, Thomas, Wanker, Erich E., Lehrach, Hans, ...
Spinocerebellar ataxia type 2 is an inherited neurodegenerative disorder that is caused by an expanded trinucleotide repeat in the SCA2 gene, encoding a polyglutamine stretch in the gene product...
Estimating cancer survival and clinical outcome based on genetic tumor progression scores (2005)
Rahnenführer, Jörg, Beerenwinkel, Niko, Schulz, Wolfgang A., Hartmann, Christian, Von Deimling, Andreas, Wullich, Bernd, ...
Motivation: In cancer research, prediction of time to death or relapse is important for a meaningful tumor classification and selecting appropriate therapies. Survival prognosis is typically based on...
Mtreemix: a software package for learning and using mixture models of mutagenetic trees (2005)
Beerenwinkel, Niko, Rahnenführer, Jörg, Kaiser, Rolf, Hoffmann, Daniel, Selbig, Joachim, Lengauer, Thomas
Summary: Mixture models of mutagenetic trees constitute a class of probabilistic models for describing evolutionary processes that are characterized by the accumulation of permanent genetic changes....
Mtreemix: a software package for learning and using mixture models of mutagenetic trees (2005)
Beerenwinke, Niko, Rahnenführer, Jörg, Kaiser, Rolf, Hoffmann, Daniel, Selbig, Joachim, Lengauer, Thomas
Summary: Mixture models of mutagenetic trees constitute a class of probabilistic models for describing evolutionary processes that are characterized by the accumulation of permanent genetic changes....
Mtreemix: a software package for learning and using mixture models of mutagenetic trees (2005)
Beerenwinkel, Niko, Rahnenführer, Jörg, Kaiser, Rolf, Hoffmann, Daniel, Selbig, Joachim, Lengauer, Thomas
Summary: Mixture models of mutagenetic trees constitute a class of probabilistic models for describing evolutionary processes that are characterized by the accumulation of permanent genetic changes....
Estimating cancer survival and clinical outcome based on genetic tumor progression scores (2005)
Rahnenführer, Jörg, Beerenwinkel, Niko, Schulz, Wolfgang A., Hartmann, Christian, Von Deimling, Andreas, Wullich, Bernd, ...
Motivation: In cancer research, prediction of time to death or relapse is important for a meaningful tumor classification and selecting appropriate therapies. Survival prognosis is typically based on...
Estimating cancer survival and clinical outcome based on genetic tumor progression scores (2005)
Rahnenführer, Jörg, Beerenwinkel, Niko, Schulz, Wolfgang A., Hartmann, Christian, Von Deimling, Andreas, Wullich, Bernd, ...
Motivation: In cancer research, prediction of time to death or relapse is important for a meaningful tumor classification and selecting appropriate therapies. Survival prognosis is typically based on...
ROCR: visualizing classifier performance in R (2005)
Sing, Tobias, Sander, Oliver, Beerenwinkel, Niko, Lengauer, Thomas
Summary: ROCR is a package for evaluating and visualizing the performance of scoring classifiers in the statistical language R. It features over 25 performance measures which can be freely combined...
Bock, Christoph, Reither, Sabine, Mikeska, Thomas, Paulsen, Martina, Walter, Jörn, Lengauer, Thomas
Summary: Manual processing of DNA methylation data from bisulphite sequencing is a tedious and error-prone task. Here we present an interactive software tool that provides start-to-end support for...
Beerenwinkel, Niko, Sing, Tobias, Lengauer, Thomas, Rahnenführer, Jörg, Roomp, Kirsten, Savenkov, Igor, ...
Motivation: The development of drug resistance is a major obstacle to successful treatment of HIV infection. The extraordinary replication dynamics of HIV facilitates its escape from selective...
Beerenwinkel, Niko, Sing, Tobias, Lengauer, Thomas, Rahnenführer, Jörg, Roomp, Kirsten, Savenkov, Igor, ...
Summary: The development of drug resistance is a major obstacle to successful treatment of HIV infection. The extraordinary replication dynamics of HIV facilitates its escape from selective pressure...
Bock, Christoph, Reither, Sabine, Mikeska, Thomas, Paulsen, Martina, Walter, Jörn, Lengauer, Thomas
Summary: Manual processing of DNA methylation data from bisulfite sequencing is a tedious and error-prone task. Here we present an interactive software tool that provides start-to-end support for...
Rahnenführer, Jörg, Domingues, Francisco S, Maydt, Jochen, Lengauer, Thomas
We present a statistical approach to scoring changes in activity of metabolic pathways from gene expression data. The method identifies the biologically relevant pathways with corresponding...
Rahnenführer, Jörg, Domingues, Francisco S, Maydt, Jochen, Lengauer, Thomas
We present a statistical approach to scoring changes in activity of metabolic pathways from gene expression data. The method identifies the biologically relevant pathways with corresponding...
Rahnenführer, Jörg, Domingues, Francisco S, Maydt, Jochen, Lengauer, Thomas
We present a statistical approach to scoring changes in activity of metabolic pathways from gene expression data. The method identifies the biologically relevant pathways with corresponding...
Rahnenführer, Jörg, Domingues, Francisco S, Maydt, Jochen, Lengauer, Thomas
We present a statistical approach to scoring changes in activity of metabolic pathways from gene expression data. The method identifies the biologically relevant pathways with corresponding...
Hofmann,W.P., Herrmann,E., Kronenberger,B., Merkwirth,Christian, Welsch,Christian, Lengauer,Thomas, ...
Predicting Protein Structure Classes from Function Predictions (2004)
Sommer,Ingolf, Rahnenführer,Jörg, Domingues,Francisco S., De Lichtenberg,Ulrik, Lengauer,Thomas
Ensemble methods for classification in cheminformatics (2004)
Merkwirth,Christian, Mauser,H., Schulz-Gasch,T., Roche,O., Stahl,M., Lengauer,Thomas
Novel technologies for virtual screening (2004)
Lengauer,Thomas, Lemmen,Christian, Rarey,Matthias, Zimmermann,M.
Modelling amorphous Si3B3N7: Structure and elastic properties (2004)
Hannemann,A., Schön,J.C., Jansen,M., Putz,H., Lengauer,Thomas
Learning multiple evolutionary pathways from cross-sectional data (2004)
Beerenwinkel,Niko, Rahnenführer,Jörg, Däumer,Martin, Hoffmann,Daniel, Kaiser,Rolf, Selbig,Joachim, ...
Genetic variation in DLG5 is associated with inflammatory bowel disease (2004)
Stoll,Monika, Corneliussen,Brit, Costello,Christine M., Waetzig,Georg H., Mellgard,Bjorn, Koch,W. Andreas, ...
Structural and functional analysis of ataxin-2 and ataxin-3 (2004)
Albrecht,Mario, Golatta,Michael, Wüllner,Ullrich, Lengauer,Thomas
Hofmann, W.P., Herrmann, E., Kronenberger, B., Merkwirth, Christian, Welsch, Christoph, Lengauer, Thomas, ...
Learning mixtures of localized rules by maximizing the area under the ROC curve (2004)
Sing, Tobias, Beerenwinkel, Niko, Lengauer, Thomas, Hernández-Orallo, José, Ferri, César, Lachiche, Nicolas, ...
Predicting Protein Structure Classes from Function Predictions (2004)
Sommer, Ingolf, Rahnenführer, Jörg, Domingues, Francisco S., De Lichtenberg, Ulrik, Lengauer, Thomas
Ensemble methods for classification in cheminformatics (2004)
Merkwirth, Christian, Mauser, H., Schulz-Gasch, T., Roche, O., Stahl, M., Lengauer, Thomas
Novel technologies for virtual screening (2004)
Lengauer, Thomas, Lemmen, Christian, Rarey, Matthias, Zimmermann, M.
Modelling amorphous Si3B3N7: Structure and elastic properties (2004)
Hannemann, A., Schön, J.C., Jansen, M., Putz, H., Lengauer, Thomas
Automated clustering of ensembles of alternative models in protein structure databases (2004)
Domingues, Francisco S., Rahnenführer, Jörg, Lengauer, Thomas
Protein Structure Prediction and Databases (2004)
Domingues, Francisco S., Lengauer, Thomas, Sommer, Ingolf, Cooper, David
Learning multiple evolutionary pathways from cross-sectional data (2004)
Beerenwinkel, Niko, Rahnenführer, Jörg, Däumer, Martin, Hoffmann, Daniel, Kaiser, Rolf, Selbig, Joachim, ...
Genetic variation in DLG5 is associated with inflammatory bowel disease (2004)
Stoll, Monika, Corneliussen, Brit, Costello, Christine M., Waetzig, Georg H., Mellgard, Bjorn, Koch, W. Andreas, ...
Structural and functional analysis of ataxin-2 and ataxin-3 (2004)
Albrecht, Mario, Golatta, Michael, Wüllner, Ullrich, Lengauer, Thomas
Learning mixtures of localized rules by maximizing the area under the ROC curve (2004)
Tobias Sing, Niko Beerenwinkel, Thomas Lengauer
Abstract. We introduce a model class for statistical learning which is based on mixtures of propositional rules. In our mixture model, the weight of a rule is not uniform over the entire instance...
Novel technologies for virtual screening (2004)
Thomas Lengauer, Thomas Lengauer, Christian Lemmen, Christian Lemmen, Matthias Rarey, Matthias Rarey, ...
There are several methods for virtual screening of databases of small organic compounds to find tight binders to a given protein target. Recent reviews in Drug Discovery Today have concentrated on...
Structural and functional analysis of ataxin-2 and ataxin-3 (2004)
Albrecht, Mario, Golatta, Michael, Wüllner, Ullrich, Lengauer, Thomas
Learning multiple evolutionary pathways from cross-sectional data (2004)
Beerenwinkel, Niko, Rahnenführer, Jörg, Däumer, Martin, Hoffmann, Daniel, Kaiser, Rolf, Selbig, Joachim, ...
Protein Structure Prediction and Databases (2004)
Domingues, Francisco S., Lengauer, Thomas, Sommer, Ingolf, Cooper, David
Automated clustering of ensembles of alternative models in protein structure databases (2004)
Domingues, Francisco S., Rahnenführer, Jörg, Lengauer, Thomas
Modelling amorphous Si3B3N7: Structure and elastic properties (2004)
Hannemann, A., Schön, J.C., Jansen, M., Putz, H., Lengauer, Thomas
Hofmann, W.P., Herrmann, E., Kronenberger, B., Merkwirth, Christian, Welsch, Christian, Lengauer, Thomas, ...
Novel technologies for virtual screening (2004)
Lengauer, Thomas, Lemmen, Christian, Rarey, Matthias, Zimmermann, M.
Ensemble methods for classification in cheminformatics (2004)
Merkwirth, Christian, Mauser, H., Schulz-Gasch, T., Roche, O., Stahl, M., Lengauer, Thomas
Learning mixtures of localized rules by maximizing the area under the ROC curve (2004)
Sing, Tobias, Beerenwinkel, Niko, Lengauer, Thomas, Hern{\'a}ndez-Orallo, Jos{\'e}, Ferri, C{\'e}sar, Lachiche, Nicolas, ...
Predicting Protein Structure Classes from Function Predictions (2004)
Sommer, Ingolf, Rahnenführer, Jörg, Domingues, Francisco S., De Lichtenberg, Ulrik, Lengauer, Thomas
Genetic variation in DLG5 is associated with inflammatory bowel disease (2004)
Stoll, Monika, Corneliussen, Brit, Costello, Christine M., Waetzig, Georg H., Mellgard, Bjorn, Koch, W. Andreas, ...
Von Öhsen, Niklas, Sommer, Ingolf, Zimmer, Ralf, Lengauer, Thomas
Motivation: Arby is a new server for protein structure prediction that combines several homology-based methods for predicting the three-dimensional structure of a protein, given its sequence. The...
Automated clustering of ensembles of alternative models in protein structure databases (2004)
Domingues, Francisco S., Rahnenführer, Jörg, Lengauer, Thomas
Experimentally determined protein structures have been classified in different public databases according to their structural and evolutionary relationships. Frequently, alternative structural...
Automated clustering of ensembles of alternative models in protein structure databases (2004)
Domingues, Francisco S., Rahnenführer, Jörg, Lengauer, Thomas
Experimentally determined protein structures have been classified in different public databases according to their structural and evolutionary relationships. Frequently, alternative structural...
Von Öhsen, Niklas, Sommer, Ingolf, Zimmer, Ralf, Lengauer, Thomas
Motivation: Arby is a new server for protein structure prediction that combines several homology-based methods for predicting the three-dimensional structure of a protein, given its sequence. The...
Von Öhsen, Niklas, Sommer, Ingolf, Zimmer, Ralf, Lengauer, Thomas
Motivation: Arby is a new server for protein structure prediction that combines several homology-based methods for predicting the three-dimensional structure of a protein, given its sequence. The...
Automated clustering of ensembles of alternative models in protein structure databases (2004)
Domingues, Francisco S., Rahnenführer, Jörg, Lengauer, Thomas
Experimentally determined protein structures have been classified in different public databases according to their structural and evolutionary relationships. Frequently, alternative structural...
Tenofovir resistance and resensitization (2003)
Walter, Hauke, Beerenwinkel, Niko, Keulen, Wilco, Kaiser, Rolf, Hoffmann, Daniel, ...
Human immunodeficiency viruses in 321 samples from tenofovir-naïve patients were retrospectively evaluated for resistance to this nucleotide analogue. All virus strains with insertions between amino...
Towards cellular function through metabolite screening (2003)
Talwar,Priti, Lengauer,Thomas, Wittmann,Christoph, Mangadu,Vidya, Heinzle,Elmar
Bioinformatikmethoden für die Optimierung antiviraler Kombinationstherapien (2003)
Beerenwinkel,Niko, Däumer,Martin, Hoffmann,Daniel, Kaiser,Rolf, Selbig,Joachim, Lengauer,Thomas
Estimating effective drug combinations against drug-resistant mutants from genotypes (2003)
Beerenwinkel,Niko, Däumer,Martin, Kaiser,Rolf, Walter,Hauke, Korn,Klaus, Hoffmann,Daniel, ...
Geno2pheno: estimating phenotypic drug resistance from HIV-1 genotypes (2003)
Beerenwinkel,Niko, Däumer,Martin, Oette,Mark, Korn,Klaus, Hoffmann,Daniel, Kaiser,Rolf, ...
Software tool for automated processing of 13C labeling data from mass spectrometry data (2003)
Talwar,Priti, Wittmann,Christoph, Lengauer,Thomas, Heinzle,Elmar
Simple consensus procedures are effective and sufficient in secondary structure prediction (2003)
Albrecht,Mario, Tosatto,Silvio C.E., Lengauer,Thomas, Valle,Giorgio
Identification of mammalian orthologs associates PYPAF5 with distinct functional roles (2003)
Albrecht,Mario, Domingues,Francisco S., Schreiber,Stefan, Lengauer,Thomas
Methods for optimizing antiviral combination therapies (2003)
Beerenwinkel,Niko, Lengauer,Thomas, Däumer,Martin, Kaiser,Rolf, Walter,Hauke, Korn,Klaus, ...
Structural modeling of ataxin-3 reveals distant homology to adaptins (2003)
Albrecht,Mario, Hoffmann,Daniel, Evert,Bernd O., Schmitt,Ina, Wüllner,Ullrich, Lengauer,Thomas
Tree models for the evolution of drug resistance (2003)
Beerenwinkel,Niko, Kaiser,Rolf, Rahnenführer,Jörg, Däumer,Martin, Hoffmann,Daniel, Selbig,Joachim, ...
Tenofovir resistance and resensitization (2003)
Wolf,Katharina, Walter,Hauke, Beerenwinkel,Niko, Keulen,Wilco, Kaiser,Rolf, Hoffmann,Daniel, ...
Towards cellular function through metabolite screening (2003)
Talwar, Priti, Lengauer, Thomas, Wittmann, Christoph, Mangadu, Vidya, Heinzle, Elmar
Bioinformatikmethoden für die Optimierung antiviraler Kombinationstherapien (2003)
Beerenwinkel, Niko, Däumer, Martin, Hoffmann, Daniel, Kaiser, Rolf, Selbig, Joachim, Lengauer, Thomas
Estimating effective drug combinations against drug-resistant mutants from genotypes (2003)
Beerenwinkel, Niko, Däumer, Martin, Kaiser, Rolf, Walter, Hauke, Korn, Klaus, Hoffmann, Daniel, ...
Geno2pheno: estimating phenotypic drug resistance from HIV-1 genotypes (2003)
Beerenwinkel, Niko, Däumer, Martin, Oette, Mark, Korn, Klaus, Hoffmann, Daniel, Kaiser, Rolf, ...
Combinatorial Optimization Techniques for Three-Dimensional Arrangement Problems (2003)
Lengauer, Thomas, Schäfer, M., Jäger, Willi, Krebs, Hans-Joachim
Software tool for automated processing of 13C labeling data from mass spectrometry data (2003)
Talwar, Priti, Wittmann, Christoph, Lengauer, Thomas, Heinzle, Elmar
Microarrays: How many do you need? (2003)
Zien, Alexander, Fluck, Juliane, Zimmer, Ralf, Lengauer, Thomas
Simple consensus procedures are effective and sufficient in secondary structure prediction (2003)
Albrecht, Mario, Tosatto, Silvio C.E., Lengauer, Thomas, Valle, Giorgio
Identification of mammalian orthologs associates PYPAF5 with distinct functional roles (2003)
Albrecht, Mario, Domingues, Francisco S., Schreiber, Stefan, Lengauer, Thomas
Methods for optimizing antiviral combination therapies (2003)
Beerenwinkel, Niko, Lengauer, Thomas, Däumer, Martin, Kaiser, Rolf, Walter, Hauke, Korn, Klaus, ...
Structural modeling of ataxin-3 reveals distant homology to adaptins (2003)
Albrecht, Mario, Hoffmann, Daniel, Evert, Bernd O., Schmitt, Ina, Wüllner, Ullrich, Lengauer, Thomas
Tree models for the evolution of drug resistance (2003)
Beerenwinkel, Niko, Kaiser, Rolf, Rahnenführer, Jörg, Däumer, Martin, Hoffmann, Daniel, Selbig, Joachim, ...
Tenofovir resistance and resensitization (2003)
Wolf, Katharina, Walter, Hauke, Beerenwinkel, Niko, Keulen, Wilco, Kaiser, Rolf, Hoffmann, Daniel, ...
DOI: 10.1093/bioinformatics/btg1001 (2003)
Niko Beerenwinkel, Thomas Lengauer, Martin Däumer, Hauke Walter, Klaus Korn, Daniel Hoffmann, ...
Vol. 19 Suppl. 1 2003, pages i16–i25
Microarrays: how many do you need (2003)
Alexander Zien, Juliane Fluck, Ralf Zimmer, Thomas Lengauer
We estimate the number of microarrays that is required in order to gain reliable results from a common type of study: the pairwise comparison of different classes of samples. We show that current...
Geno2pheno: estimating phenotypic drug resistance from HIV-1 genotypes (2003)
Beerenwinkel, Niko, Däumer, Martin, Oette, Mark, Korn, Klaus, Hoffmann, Daniel, Kaiser, Rolf, ...
Therapeutic success of anti-HIV therapies is limited by the development of drug resistant viruses. These genetic variants display complex mutational patterns in their pol gene, which codes for...
Simple consensus procedures are effective and sufficient in secondary structure prediction (2003)
Albrecht, Mario, Tosatto, Silvio C.E., Lengauer, Thomas, Valle, Giorgio
We have analyzed the performance of majority voting on minimal combination sets of three state‐of‐the‐art secondary structure prediction methods in order to obtain a consensus...
Pyranose oxidase identified as a member of the GMC oxidoreductase family (2003)
Albrecht, Mario, Lengauer, Thomas
Fungal pyranose oxidase is a flavoenzyme whose preferred substrate among several monosaccharides is d-glucose. After a comprehensive analysis of conserved features in a structure-based multiple...
Analyzing resistance phenomena in HIV with bioinformatics methods (2003)
We report on research that is targeted towards understanding the resistance phenomena that HIV undergoes in the presence of selective pressure presented by combination drug therapies. The ultimate...
Methods for optimizing antiviral combination therapies (2003)
Beerenwinkel, Niko, Lengauer, Thomas, Däumer, Martin, Kaiser, Rolf, Walter, Hauke, Korn, Klaus, ...
Motivation: Despite some progress with antiretroviral combination therapies, therapeutic success in the management of HIV-infected patients is limited. The evolution of drug-resistant genetic...
Albrecht, Mario, Lengauer, Thomas, Schreiber, Stefan
Sequence variations in the gene products PYPAF1/CIAS1 and NOD2/CARD15 have been associated with several autoinflammatory diseases that, although clinically different, share a similar inflammatory...
Improving fold recognition of protein threading by experimental distance constraints (2002)
Albrecht,Mario, Hanisch,Daniel, Zimmer,Ralf, Lengauer,Thomas
Confidence measures for protein fold recognition (2002)
Sommer,Ingolf, Zien,Alexander, Öhsen Von,Niklas, Zimmer,Ralf, Lengauer,Thomas
Geno2pheno is predictive of short-term virological response (2002)
Beerenwinkel,Niko, Lengauer,Thomas, Däumer,Martin, Sierra,S., Schmidt,Barbara, Walter,Hauke, ...
Quantitative phenotype prediction by support vector machines (2002)
Beerenwinkel,Niko, Lengauer,Thomas, Schmidt,Barbara, Walter,Hauke, Kaiser,Rolf, Hoffmann,Daniel, ...
Co-clustering of biological networks and gene expression data (2002)
Hanisch,Daniel, Zien,Alexander, Zimmer,Ralf, Lengauer,Thomas
Beerenwinkel,Niko, Schmidt,Barbara, Walter,Hauke, Kaiser,Rolf, Lengauer,Thomas, Hoffmann,Daniel, ...
Flexible docking under pharmacophore type constraints (2002)
Hindle,Sally A., Rarey,Matthias, Buning,Christian, Lengauer,Thomas
A Fast Algorithm for finding Dominators in a Flow Graph, (2002)
Lengauer,Thomas, Tarjan,Robert Endre
This paper presents a fast algorithm for finding dominators in a flow graph. The algorithm uses depth-first search and an efficient method of computing functions defined on paths in trees. A simple...
Althaus, Ernst, Caprara, Alberto, Lenhof, Hans-Peter, Reinert, Knut, Lengauer, Thomas
Multiple sequence alignment is one of the dominant problems in computational molecular biology. Numerous scoring functions and methods have been proposed, most of which result in NP-hard problems. In...
Improving fold recognition of protein threading by experimental distance constraints (2002)
Albrecht, Mario, Hanisch, Daniel, Zimmer, Ralf, Lengauer, Thomas
Microarrays: How Many Do You Need? (2002)
Zien, Alexander, Fluck, Juliane, Zimmer, Ralf, Lengauer, Thomas, Myers, Gene, Hannenhalli, Sridhar, ...
Confidence measures for protein fold recognition (2002)
Sommer, Ingolf, Zien, Alexander, Öhsen Von, Niklas, Zimmer, Ralf, Lengauer, Thomas
Geno2pheno is predictive of short-term virological response (2002)
Beerenwinkel, Niko, Lengauer, Thomas, Däumer, Martin, Sierra, S., Schmidt, Barbara, Walter, Hauke, ...
Quantitative phenotype prediction by support vector machines (2002)
Beerenwinkel, Niko, Lengauer, Thomas, Schmidt, Barbara, Walter, Hauke, Kaiser, Rolf, Hoffmann, Daniel, ...
Co-clustering of biological networks and gene expression data (2002)
Hanisch, Daniel, Zien, Alexander, Zimmer, Ralf, Lengauer, Thomas
Beerenwinkel, Niko, Schmidt, Barbara, Walter, Hauke, Kaiser, Rolf, Lengauer, Thomas, Hoffmann, Daniel, ...
Flexible docking under pharmacophore type constraints (2002)
Hindle, Sally A., Rarey, Matthias, Buning, Christian, Lengauer, Thomas
Confidence measures for protein fold recognition (2002)
Sommer, Ingolf, Zien, Alexander, Von Öhsen, Niklas, Zimmer, Ralf, Lengauer, Thomas
Motivation: We present an extensive evaluation of different methods and criteria to detect remote homologs of a given protein sequence. We investigate two associated problems: first, to develop a...
Co-clustering of biological networks and gene expression data (2002)
Hanisch, Daniel, Zien, Alexander, Zimmer, Ralf, Lengauer, Thomas
Motivation: Large scale gene expression data are often analysed by clustering genes based on gene expression data alone, though a priori knowledge in the form of biological networks is available. The...
Centralization: a new method for the normalization of gene expression data (2001)
Zien, Alexander, Aigner, Thomas, Zimmer, Ralf, Lengauer, Thomas
Microarrays measure values that are approximately proportional to the numbers of copies of different mRNA molecules in samples. Due to technical difficulties, the constant of proportionality between...
Analysis of gene expression data with pathway scores (2000)
Er Zien, Robert Ku Ner, Ralf Zimmer, Thomas Lengauer
We present a new approach for the evaluation of gene expression data. The basic idea is to generate biologically possible pathways and to score them with respect to gene expression measurements. We...
Analysis of gene expression data with pathway scores (2000)
Er Zien, Robert Kuffner, Ralf Zimmer, Thomas Lengauer
We present a new approach for the evaluation of gene expression data. The basic idea is to generate biologically possible pathways and to score them with respect to gene expression measurements. We...
Analysis of Gene Expression Data with Pathway Scores (2000)
Alexander Zien, Robert Küffner, Er Zien, Robert Ku Ner, Ralf Zimmer, Thomas Lengauer
Wepresent a new approachfortheevaluation of gene expression data. The basic idea is to generate biologically possible pathways and to score them with respect to gene expression measurements. We...
Protein structure prediction methods for drug design (2000)
Lengauer, Thomas, Zimmer, Ralf
Along the long path from genomic data to a new drug, the knowledge of three-dimensional protein structure can be of significant help in several places. This paper points out such places, discusses...
Pathway analysis in metabolic databases via differential metabolic display (DMD) (2000)
Küffner, Robert, Zimmer, Ralf, Lengauer, Thomas
Motivation: A number of metabolic databases are available electronically, some with features for querying and visualizing metabolic pathways and regulatory networks. We present a unifying, systematic...
Decision tree-based formation of consensus protein secondary structure prediction (1999)
Selbig, Joachim, Mevissen, Theo, Lengauer, Thomas
Motivation: Prediction of protein secondary structure provides information that is useful for other prediction methods like fold recognition and ab initio 3D prediction. A consensus prediction...
Lengauer T.; Parallel “go with the winners algorithms” in the LogP Model (1997)
Marcus Peinado, Thomas Lengauer
We parallelize the ‘Go with the winners ’ algorithm of Aldous and Vazirani [1] and analyze the resulting parallel algorithm in the LogP-model [4]. The main issues in the analysis are load...
Lengauer T.; Parallel “go with the winners algorithms” in the LogP Model (1997)
Marcus Peinado, Thomas Lengauer
We parallelize the `Go with the winners ' algorithm of Aldous and Vazirani [1] and analyze the resulting parallel algorithm in the LogP-model [4]. The main issues in the analysis are load...
A Fast Flexible Docking Method using an Incremental Construction Algorithm (1996)
Matthias Rarey, Bernd Kramer, Thomas Lengauer, Gerhard Klebe
We present an automatic method for docking organic ligands into protein Center for Information binding sites. The method can be used in the design process of specific Technology (GMD), Institute...
On the selection of candidates for point and line correspondences (1995)
Stefan Lanser, Thomas Lengauer
This paper addresses the selection of possible candidates for point or line correspondences between model and image features in the context of pose estimation or navigation tasks. The selection...
Recursive Dynamic Programming for Adaptive Sequence and Structure Alignment (1995)
Ralf Thiele, Ralf Zimmer, Thomas Lengauer
We propose a new alignment procedure that is capable of aligning protein sequences and structures in a unified manner. Recursive dynamic programming (RDP) is a hierarchical method which, on each...
On the Construction of Abstract Voronoi Diagrams (1990)
Mehlhorn, Kurt, Meiser, Stefan, Ó'Dúnlaing, Colm, Choffrut, Christian, Lengauer, Thomas
Upper and lower bounds on time-space tradeoffs in a pebble game / (1979)
Thesis--Stanford University.
Upper and lower bounds on time-space tradeoffs in a pebble game /--Thomas Lengauer. (1979)
Microfiche (negative). -- 1 sheet ; 11 x 15 cm.
A fast algorithm for finding dominators in a flowgraph (1979)
Thomas Lengauer, Robert Endre, Tar Jan
A fast algoritbm for finding dominators in a flowgraph is presented. The algorithm uses depth-first search and an efficient method of computing functions defined on paths in trees. A simple...
Strukturelle Aspekte der Nebenläufigkeit / (1976)
Zugl.: Berlin, Freie Univ., Fachbereich 19 - Mathematik, Diss., 1975.
Beerenwinkel, Niko, Schmidt, Barbara, Walter, Hauke, Kaiser, Rolf, Lengauer, Thomas, Hoffmann, Daniel, ...
Drug resistance testing has been shown to be beneficial for clinical management of HIV type 1 infected patients. Whereas phenotypic assays directly measure drug resistance, the commonly used...
Geno2pheno: estimating phenotypic drug resistance from HIV-1 genotypes
Beerenwinkel, Niko, Däumer, Martin, Oette, Mark, Korn, Klaus, Hoffmann, Daniel, Kaiser, Rolf, ...
Therapeutic success of anti-HIV therapies is limited by the development of drug resistant viruses. These genetic variants display complex mutational patterns in their pol gene, which codes for...
Tenofovir Resistance and Resensitization
Wolf, Katharina, Walter, Hauke, Beerenwinkel, Niko, Keulen, Wilco, Kaiser, Rolf, Hoffmann, Daniel, ...
Human immunodeficiency viruses in 321 samples from tenofovir-naïve patients were retrospectively evaluated for resistance to this nucleotide analogue. All virus strains with insertions between amino...
Confirmation of human protein interaction data by human expression data
Hahn, Andreas, Rahnenführer, Jörg, Talwar, Priti, Lengauer, Thomas
Dissection of the Inflammatory Bowel Disease Transcriptome Using Genome-Wide cDNA Microarrays
Costello, Christine M, Mah, Nancy, Häsler, Robert, Rosenstiel, Philip, Waetzig, Georg H, Hahn, Andreas, ...
cDNA analysis of colonic samples from patients with Crohn disease and ulcerative colitis suggests substantial differences in pathophysiology between the two diseases.
NOXclass: prediction of protein-protein interaction types
Zhu, Hongbo, Domingues, Francisco S, Sommer, Lngolf, Lengauer, Thomas
Bock, Christoph, Paulsen, Martina, Tierling, Sascha, Mikeska, Thomas, Lengauer, Thomas, Walter, Jörn
CpG island methylation plays an important role in epigenetic gene control during mammalian development and is frequently altered in disease situations such as cancer. The majority of CpG islands is...
Castellano, Sergi, Lobanov, Alexey V., Chapple, Charles, Novoselov, Sergey V., Albrecht, Mario, Hua, Deame, ...
Selenoproteins are a diverse group of proteins that contain selenocysteine (Sec), the 21st amino acid. In the genetic code, UGA serves as a termination signal and a Sec codon. This dual role has...
Mutations in the NB-ARC Domain of I-2 That Impair ATP Hydrolysis Cause Autoactivation1[OA]
Tameling, Wladimir I.L., Vossen, Jack H., Albrecht, Mario, Lengauer, Thomas, Berden, Jan A., Haring, Michel A., ...
Resistance (R) proteins in plants confer specificity to the innate immune system. Most R proteins have a centrally located NB-ARC (nucleotide-binding adaptor shared by APAF-1, R proteins, and CED-4)...
A new measure for functional similarity of gene products based on Gene Ontology
Schlicker, Andreas, Domingues, Francisco S, Rahnenführer, Jörg, Lengauer, Thomas
Improving the quality of protein structure models by selecting from alignment alternatives
Sommer, Ingolf, Toppo, Stefano, Sander, Oliver, Lengauer, Thomas, Tosatto, Silvio CE
Svicher, Valentina, Sing, Tobias, Santoro, Maria Mercedes, Forbici, Federica, Rodríguez-Barrios, Fátima, Bertoli, Ada, ...
We characterized 16 additional mutations in human immunodeficiency virus type 1 (HIV-1) reverse transcriptase (RT) whose role in drug resistance is still unknown by analyzing 1,906 plasma-derived...
Wemmert, Silke, Ketter, Ralf, Rahnenführer, Jörg, Beerenwinkel, Niko, Strowitzki, Martin, Feiden, Wolfgang, ...
Surgical cure of glioblastomas is virtually impossible and their clinical course is mainly determined by the biologic behavior of the tumor cells and their response to radiation and chemotherapy. We...
Beerenwinkel, Niko, Schmidt, Barbara, Walter, Hauke, Kaiser, Rolf, Lengauer, Thomas, Hoffmann, Daniel, ...
Drug resistance testing has been shown to be beneficial for clinical management of HIV type 1 infected patients. Whereas phenotypic assays directly measure drug resistance, the commonly used...
Geno2pheno: estimating phenotypic drug resistance from HIV-1 genotypes
Beerenwinkel, Niko, Däumer, Martin, Oette, Mark, Korn, Klaus, Hoffmann, Daniel, Kaiser, Rolf, ...
Therapeutic success of anti-HIV therapies is limited by the development of drug resistant viruses. These genetic variants display complex mutational patterns in their pol gene, which codes for...
Tenofovir Resistance and Resensitization
Wolf, Katharina, Walter, Hauke, Beerenwinkel, Niko, Keulen, Wilco, Kaiser, Rolf, Hoffmann, Daniel, ...
Human immunodeficiency viruses in 321 samples from tenofovir-naïve patients were retrospectively evaluated for resistance to this nucleotide analogue. All virus strains with insertions between amino...
Confirmation of human protein interaction data by human expression data
Hahn, Andreas, Rahnenführer, Jörg, Talwar, Priti, Lengauer, Thomas
Dissection of the Inflammatory Bowel Disease Transcriptome Using Genome-Wide cDNA Microarrays
Costello, Christine M, Mah, Nancy, Häsler, Robert, Rosenstiel, Philip, Waetzig, Georg H, Hahn, Andreas, ...
cDNA analysis of colonic samples from patients with Crohn disease and ulcerative colitis suggests substantial differences in pathophysiology between the two diseases.
Castellano, Sergi, Lobanov, Alexey V., Chapple, Charles, Novoselov, Sergey V., Albrecht, Mario, Hua, Deame, ...
Selenoproteins are a diverse group of proteins that contain selenocysteine (Sec), the 21st amino acid. In the genetic code, UGA serves as a termination signal and a Sec codon. This dual role has...
NOXclass: prediction of protein-protein interaction types
Zhu, Hongbo, Domingues, Francisco S, Sommer, Lngolf, Lengauer, Thomas
Bock, Christoph, Paulsen, Martina, Tierling, Sascha, Mikeska, Thomas, Lengauer, Thomas, Walter, Jörn
CpG island methylation plays an important role in epigenetic gene control during mammalian development and is frequently altered in disease situations such as cancer. The majority of CpG islands is...
Svicher, Valentina, Sing, Tobias, Santoro, Maria Mercedes, Forbici, Federica, Rodríguez-Barrios, Fátima, Bertoli, Ada, ...
We characterized 16 additional mutations in human immunodeficiency virus type 1 (HIV-1) reverse transcriptase (RT) whose role in drug resistance is still unknown by analyzing 1,906 plasma-derived...
Wemmert, Silke, Ketter, Ralf, Rahnenführer, Jörg, Beerenwinkel, Niko, Strowitzki, Martin, Feiden, Wolfgang, ...
Surgical cure of glioblastomas is virtually impossible and their clinical course is mainly determined by the biologic behavior of the tumor cells and their response to radiation and chemotherapy. We...
A new measure for functional similarity of gene products based on Gene Ontology
Schlicker, Andreas, Domingues, Francisco S, Rahnenführer, Jörg, Lengauer, Thomas
Improving the quality of protein structure models by selecting from alignment alternatives
Sommer, Ingolf, Toppo, Stefano, Sander, Oliver, Lengauer, Thomas, Tosatto, Silvio CE
Schulz, Wolfgang A, Alexa, Adrian, Jung, Volker, Hader, Christiane, Hoffmann, Michèle J, Yamanaka, Masanori, ...
Mutations in the MutSα interaction interface of MLH1 can abolish DNA mismatch repair
Plotz, Guido, Welsch, Christoph, Giron-Monzon, Luis, Friedhoff, Peter, Albrecht, Mario, Piiper, Albrecht, ...
MutLα, a heterodimer of MLH1 and PMS2, plays a central role in human DNA mismatch repair. It interacts ATP-dependently with the mismatch detector MutSα and assembles and controls further repair...
Mutations in the NB-ARC Domain of I-2 That Impair ATP Hydrolysis Cause Autoactivation1[OA]
Tameling, Wladimir I.L., Vossen, Jack H., Albrecht, Mario, Lengauer, Thomas, Berden, Jan A., Haring, Michel A., ...
Resistance (R) proteins in plants confer specificity to the innate immune system. Most R proteins have a centrally located NB-ARC (nucleotide-binding adaptor shared by APAF-1, R proteins, and CED-4)...
Structural Descriptors of gp120 V3 Loop for the Prediction of HIV-1 Coreceptor Usage
Sander, Oliver, Sing, Tobias, Sommer, Ingolf, Low, Andrew J, Cheung, Peter K, Harrigan, P. Richard, ...
HIV-1 cell entry commonly uses, in addition to CD4, one of the chemokine receptors CCR5 or CXCR4 as coreceptor. Knowledge of coreceptor usage is critical for monitoring disease progression as well as...
GOTax: investigating biological processes and biochemical activities along the taxonomic tree
Schlicker, Andreas, Rahnenführer, Jörg, Albrecht, Mario, Lengauer, Thomas, Domingues, Francisco S
GOTax, a novel web-based platform that integrates protein annotation with protein family classification and taxonomy, allows for an extensive assessment of functional similarity between proteins and...
Expression pattern analysis of transcribed HERV sequences is complicated by ex vivo recombination
Flockerzi, Aline, Maydt, Jochen, Frank, Oliver, Ruggieri, Alessia, Maldener, Esther, Seifarth, Wolfgang, ...
CpG Island Mapping by Epigenome Prediction
Bock, Christoph, Walter, Jörn, Paulsen, Martina, Lengauer, Thomas
CpG islands were originally identified by epigenetic and functional properties, namely, absence of DNA methylation and frequent promoter association. However, this concept was quickly replaced by...
The implications of alternative splicing in the ENCODE protein complement
Tress, Michael L., Martelli, Pier Luigi, Frankish, Adam, Reeves, Gabrielle A., Wesselink, Jan Jaap, Yeats, Corin, ...
Alternative premessenger RNA splicing enables genes to generate more than one gene product. Splicing events that occur within protein coding regions have the potential to alter the biological...
Ceccherini-Silberstein, Francesca, Svicher, Valentina, Sing, Tobias, Artese, Anna, Santoro, Maria Mercedes, Forbici, Federica, ...
Resistance to antivirals is a complex and dynamic phenomenon that involves more mutations than are currently known. Here, we characterize 10 additional mutations (L74V, K101Q, I135M/T, V179I, H221Y,...
Ahlenstiel, Golo, Roomp, Kirsten, Däumer, Martin, Nattermann, Jacob, Vogel, Martin, Rockstroh, Jürgen K., ...
The objective of this study was a comprehensive analysis of the immune-driven evolution of viruses of human immunodeficiency virus type 1 (HIV-1) clade B in a large patient cohort treated at a single...
Alignment of Non-Covalent Interactions at Protein-Protein Interfaces
Zhu, Hongbo, Sommer, Ingolf, Lengauer, Thomas, Domingues, Francisco S.
Model Selection for Mixtures of Mutagenetic Trees
Junming Yin, Niko Beerenwinkel, Jörg Rahnenführer, Thomas Lengauer
The evolution of drug resistance in HIV is characterized by the accumulation of resistance-associated mutations in the HIV genome. Mutagenetic trees, a family of restricted Bayesian tree models, have...
Calculating the Statistical Significance of Changes in Pathway Activity From Gene Expression Data
Jörg Rahnenführer, Francisco Domingues, Jochen Maydt, Thomas Lengauer
We present a statistical approach to scoring changes in activity of metabolic pathways from gene expression data. The method identifies the biologically relevant pathways with corresponding...
Welsch, Christoph, Domingues, Francisco S, Susser, Simone, Antes, Iris, Hartmann, Christoph, Mayr, Gabriele, ...
Structural analysis of the inhibitor Telaprevir (VX-950) of the hepatitis C virus (HCV) protease NS3-4A shows that mutations at V36 and/or T54 result in impaired interaction with VX-950, explaining...
Hartmann, Christoph, Antes, Iris, Lengauer, Thomas
We introduce a new algorithm, IRECS (Iterative REduction of Conformational Space), for identifying ensembles of most probable side-chain conformations for homology modeling. On the basis of a given...
Inter-individual variation of DNA methylation and its implications for large-scale epigenome mapping
Bock, Christoph, Walter, Jörn, Paulsen, Martina, Lengauer, Thomas
Genomic DNA methylation profiles exhibit substantial variation within the human population, with important functional implications for gene regulation. So far little is known about the...
Local Function Conservation in Sequence and Structure Space
Weinhold, Nils, Sander, Oliver, Domingues, Francisco S., Lengauer, Thomas, Sommer, Ingolf
We assess the variability of protein function in protein sequence and structure space. Various regions in this space exhibit considerable difference in the local conservation of molecular function....
Rtreemix: an R package for estimating evolutionary pathways and genetic progression scores
Bogojeska, Jasmina, Alexa, Adrian, Altmann, André, Lengauer, Thomas, Rahnenführer, Jörg
Summary: In genetics, many evolutionary pathways can be modeled by the ordered accumulation of permanent changes. Mixture models of mutagenetic trees have been used to describe disease progression in...
Comparison of Classifier Fusion Methods for Predicting Response to Anti HIV-1 Therapy
Altmann, André, Rosen-Zvi, Michal, Prosperi, Mattia, Aharoni, Ehud, Neuvirth, Hani, Schülter, Eugen, ...
Integrating expression data with domain interaction networks
Emig, Dorothea, Cline, Melissa S., Lengauer, Thomas, Albrecht, Mario
Summary: Recent studies have revealed that alternative splicing plays an important role in the observed protein and interaction diversity. Special microarrays allow for measuring gene expression at...
EpiGRAPH: user-friendly software for statistical analysis and prediction of (epi)genomic data
Bock, Christoph, Halachev, Konstantin, Büch, Joachim, Lengauer, Thomas
EpiGRAPH is a genome-scale data-mining software tool that enables users to identify epigenetic and gene regulatory features in large datasets of genomic regions.
DASMI: exchanging, annotating and assessing molecular interaction data
Blankenburg, Hagen, Finn, Robert D., Prlić, Andreas, Jenkinson, Andrew M., Ramírez, Fidel, Emig, Dorothea, ...
Motivation: Ever increasing amounts of biological interaction data are being accumulated worldwide, but they are currently not readily accessible to the biologist at a single site. New techniques are...
Selecting anti-HIV therapies based on a variety of genomic and clinical factors
Rosen-Zvi, Michal, Altmann, Andre, Prosperi, Mattia, Aharoni, Ehud, Neuvirth, Hani, Sönnerborg, Anders, ...
Motivation: Optimizing HIV therapies is crucial since the virus rapidly develops mutations to evade drug pressure. Recent studies have shown that genotypic information might not be sufficient for the...
Bozek, Katarzyna, Thielen, Alexander, Sierra, Saleta, Kaiser, Rolf, Lengauer, Thomas
The V3 loop of human immunodeficiency virus type 1 (HIV-1) is critical for coreceptor binding and is the main determinant of which of the cellular coreceptors, CCR5 or CXCR4, the virus uses for cell...