相关参考文献
注意：仅列出部分参考文献，下载原文获取全部文献信息。Random forest Gini importance favours SNPs with large minor allele frequency: impact, sources and recommendations
Anne-Laure Boulesteix et al.
BRIEFINGS IN BIOINFORMATICS (2012)
Target-drug interactions: first principles and their application to drug discovery
Sara Nunez et al.
DRUG DISCOVERY TODAY (2012)
ChEMBL: a large-scale bioactivity database for drug discovery
Anna Gaulton et al.
NUCLEIC ACIDS RESEARCH (2012)
Gaussian interaction profile kernels for predicting drug-target interaction
Twan van Laarhoven et al.
BIOINFORMATICS (2011)
Computational methods for drug repurposing
Philippe Sanseau et al.
BRIEFINGS IN BIOINFORMATICS (2011)
Exploiting drug-disease relationships for computational drug repositioning
Joel T. Dudley et al.
BRIEFINGS IN BIOINFORMATICS (2011)
Predicting Drug-Target Interactions Based on an Improved Semi-Supervised Learning Approach
Weiming Yu et al.
DRUG DEVELOPMENT RESEARCH (2011)
Computational Screening for Active Compounds Targeting Protein Sequences: Methodology and Experimental Validation
Fei Wang et al.
JOURNAL OF CHEMICAL INFORMATION AND MODELING (2011)
A Call to Arms: What You Can Do for Computational Drug Discovery
Heather A. Carlson et al.
JOURNAL OF CHEMICAL INFORMATION AND MODELING (2011)
Predicting selective drug targets in cancer through metabolic networks
Ori Folger et al.
MOLECULAR SYSTEMS BIOLOGY (2011)
Trends in the exploitation of novel drug targets
Mathias Rask-Andersen et al.
NATURE REVIEWS DRUG DISCOVERY (2011)
DrugBank 3.0: a comprehensive resource for 'Omics' research on drugs
Craig Knox et al.
NUCLEIC ACIDS RESEARCH (2011)
DRAR-CPI: a server for identifying drug repositioning potential and adverse drug reactions via the chemical-protein interactome
Heng Luo et al.
NUCLEIC ACIDS RESEARCH (2011)
Which Compound to Select in Lead Optimization? Prospectively Validated Proteochemometric Models Guide Preclinical Development
Gerard J. P. van Westen et al.
PLOS ONE (2011)
Semi-supervised drug-protein interaction prediction from heterogeneous biological spaces
Zheng Xia et al.
BMC SYSTEMS BIOLOGY (2010)
An overview of the PubChem BioAssay resource
Yanli Wang et al.
NUCLEIC ACIDS RESEARCH (2010)
Predicting Drug-Target Interaction Networks Based on Functional Groups and Biological Features
Zhisong He et al.
PLOS ONE (2010)
Novel opportunities for computational biology and sociology in drug discovery (vol 27, pg 531, 2009)
Lixia Yao et al.
TRENDS IN BIOTECHNOLOGY (2010)
Prediction of DNA-binding residues in proteins from amino acid sequences using a random forest model with a hybrid feature
Jiansheng Wu et al.
BIOINFORMATICS (2009)
Supervised prediction of drug-target interactions using bipartite local models
Kevin Bleakley et al.
BIOINFORMATICS (2009)
Automated Docking Screens: A Feasibility Study
John J. Irwin et al.
JOURNAL OF MEDICINAL CHEMISTRY (2009)
The topology of drug-target interaction networks: implicit dependence on drug properties and target families
Jordi Mestres et al.
MOLECULAR BIOSYSTEMS (2009)
Predicting new molecular targets for known drugs
Michael J. Keiser et al.
NATURE (2009)
Protein-ligand interaction prediction: an improved chemogenomics approach
Laurent Jacob et al.
BIOINFORMATICS (2008)
Prediction of drug-target interaction networks from the integration of chemical and genomic spaces
Yoshihiro Yamanishi et al.
BIOINFORMATICS (2008)
Virtual screening of GPCRs:: An in silico chemogenomics approach
Laurent Jacob et al.
BMC BIOINFORMATICS (2008)
Large-scale prediction of drug-target relationships
Michael Kuhn et al.
FEBS LETTERS (2008)
Network pharmacology: the next paradigm in drug discovery
Andrew L. Hopkins
NATURE CHEMICAL BIOLOGY (2008)
SuperPred:: drug classification and target prediction
Mathias Dunkel et al.
NUCLEIC ACIDS RESEARCH (2008)
Drug target identification using side-effect similarity
Monica Campillos et al.
SCIENCE (2008)
Drug-target network
Muhammed A. Yildirim et al.
NATURE BIOTECHNOLOGY (2007)
Relating protein pharmacology by ligand chemistry
Michael J. Keiser et al.
NATURE BIOTECHNOLOGY (2007)
Chemogenomic approaches to rational drug design
D. Rognan
BRITISH JOURNAL OF PHARMACOLOGY (2007)
BindingDB: a web-accessible database of experimentally determined protein-ligand binding affinities
Tiqing Liu et al.
NUCLEIC ACIDS RESEARCH (2007)
Innovation - The Connectivity Map: a new tool for biomedical research
Justin Lamb
NATURE REVIEWS CANCER (2007)
Opinion - How many drug targets are there?
John P. Overington et al.
NATURE REVIEWS DRUG DISCOVERY (2006)
Benchmarking sets for molecular docking
Niu Huang et al.
JOURNAL OF MEDICINAL CHEMISTRY (2006)
Chemogenomics: structuring the drug discovery process to gene families
C. John Harris et al.
DRUG DISCOVERY TODAY (2006)
The connectivity map: Using gene-expression signatures to connect small molecules, genes, and disease
Justin Lamb et al.
SCIENCE (2006)
Global mapping of pharmacological space
Gaia V. Paolini et al.
NATURE BIOTECHNOLOGY (2006)
Gene selection and classification of microarray data using random forest -: art. no. 3
R Díaz-Uriarte et al.
BMC BIOINFORMATICS (2006)
AffinDB: a freely accessible database of affinities for protein-ligand complexes from the PDB
Peter Block et al.
NUCLEIC ACIDS RESEARCH (2006)
An introduction to ROC analysis
Tom Fawcett
PATTERN RECOGNITION LETTERS (2006)
Prediction of protein-protein interactions using random decision forest framework
XW Chen et al.
BIOINFORMATICS (2005)
Kernel methods for predicting protein-protein interactions
A Ben-Hur et al.
BIOINFORMATICS (2005)
Tumor classification by tissue microarray profiling: random forest clustering applied to renal cell carcinoma
T Shi et al.
MODERN PATHOLOGY (2005)
Gene mining: a novel and powerful ensemble decision approach to hunting for disease genes using microarray expression profiling
X Li et al.
NUCLEIC ACIDS RESEARCH (2004)
Chemogenomics: An emerging strategy for rapid target and drug discovery
M Bredel et al.
NATURE REVIEWS GENETICS (2004)
Magic shotguns versus magic bullets: selectively non-selective drugs for mood disorders and schizophrenia
BL Roth et al.
NATURE REVIEWS DRUG DISCOVERY (2004)
Network biology:: Understanding the cell's functional organization
AL Barabási et al.
NATURE REVIEWS GENETICS (2004)
Drug repositioning: Identifying and developing new uses for existing drugs
TT Ashburn et al.
NATURE REVIEWS DRUG DISCOVERY (2004)
H1-histamine receptor affinity predicts short-term weight gain for typical and atypical antipsychotic drugs
AJ Goudie et al.
NEUROPSYCHOPHARMACOLOGY (2003)
Atypical antipsychotic drug actions: unitary or multiple mechanisms for 'atypicality?
BL Roth et al.
CLINICAL NEUROSCIENCE RESEARCH (2003)
Cell and tumor classification using gene expression data: Construction of forests
HP Zhang et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2003)
Random forest: A classification and regression tool for compound classification and QSAR modeling
V Svetnik et al.
JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES (2003)
Do structurally similar molecules have similar biological activity?
YC Martin et al.
JOURNAL OF MEDICINAL CHEMISTRY (2002)
Lead discovery using molecular docking
BK Shoichet et al.
CURRENT OPINION IN CHEMICAL BIOLOGY (2002)
The construction and assessment of a statistical model for the prediction of protein assay data
J Pittman et al.
JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES (2002)
分享论文
