المؤلفون: Andrei Victor Anghelescu, Xiaoming Xie, Anthony E. Klon, Robert Kirk DeLisle, Jeffrey F. Lowrie, David J. Diller

المصدر: Journal of Chemical Information and Modeling. 48:1041-1054

مصطلحات موضوعية: Receptors, CXCR3, biology, Stereochemistry, Chemistry, General Chemical Engineering, hERG, Molecular Conformation, General Chemistry, Library and Information Sciences, Lower dimensional space, Ligands, Estrogen Receptor Agonists, Computer Science Applications, Estrogen Receptor Antagonists, Receptors, Estrogen, Potassium Channel Blockers, biology.protein, Biological system, Algorithms

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::488eb52849aff987dfae89483a8573af
https://doi.org/10.1021/ci700395f

المؤلفون: Steven L. Dixon, G. Madhavi Sastry, Jeffrey F. Lowrie, Woody Sherman

المصدر: Journal of chemical information and modeling. 50(5)

مصطلحات موضوعية: Virtual screening, Similarity (geometry), Databases, Factual, Molecular Structure, Computer science, General Chemical Engineering, Specific-information, Fingerprint (computing), Scale (descriptive set theory), General Chemistry, Library and Information Sciences, computer.software_genre, ENCODE, Computer Science Applications, Set (abstract data type), Structure-Activity Relationship, Cheminformatics, Drug Design, Data mining, computer

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::56ab938e65ec6937fa9857ddef2d5e3c
https://pubmed.ncbi.nlm.nih.gov/20450209

المؤلفون: Jianxin Duan, Jeffrey F. Lowrie, Woody Sherman, Steven L. Dixon

المصدر: Journal of molecular graphicsmodelling. 29(2)

مصطلحات موضوعية: Models, Molecular, Similarity (geometry), Computer science, Data_MISCELLANEOUS, Drug Evaluation, Preclinical, computer.software_genre, Ligands, User-Computer Interface, Software, Materials Chemistry, Physical and Theoretical Chemistry, Spectroscopy, Virtual screening, business.industry, Fingerprint (computing), Computer Graphics and Computer-Aided Design, Molecular Weight, Databases as Topic, Cheminformatics, Complementarity (molecular biology), Metric (mathematics), Pairwise comparison, Data mining, business, computer

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::e342723954a99f2384398abb6bf094aa
https://pubmed.ncbi.nlm.nih.gov/20579912

المؤلفون: Xiaoming Xie, Andrei Victor Anghelescu, Anthony E. Klon, Robert Kirk DeLisle, Jeffrey F. Lowrie, David J. Diller

المصدر: ChemInform. 39

مصطلحات موضوعية: biology, Chemistry, hERG, biology.protein, General Medicine, Lower dimensional space, Biological system, Estrogen Receptor Agonists, Estrogen Receptor Antagonists

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::de830f7e132c89359a1e4d4c1bb0c807
https://doi.org/10.1002/chin.200833218

المؤلفون: Anthony E. Klon, David J. Diller, Jeffrey F. Lowrie

المصدر: Journal of chemical information and modeling. 46(5)

مصطلحات موضوعية: Property (programming), Computer science, General Chemical Engineering, Gaussian, Library and Information Sciences, Machine learning, computer.software_genre, Intestinal absorption, Naive Bayes classifier, symbols.namesake, Bayes' theorem, Humans, Pharmacokinetics, Absorption (logic), ADME, Chemistry, Naive bayesian classifier, business.industry, Pattern recognition, Bayes Theorem, General Medicine, General Chemistry, Blood Proteins, Variable-order Bayesian network, Computer Science Applications, ComputingMethodologies_PATTERNRECOGNITION, Distribution (mathematics), Intestinal Absorption, ROC Curve, Blood-Brain Barrier, Binary data, symbols, Artificial intelligence, business, computer

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::026d658c22521aee699a94ed8266a553
https://pubmed.ncbi.nlm.nih.gov/16995725

المؤلفون: Jeffrey F. Lowrie, Robert Kirk Delisle, David J. Diller, Doug W. Hobbs

المصدر: Combinatorial chemistryhigh throughput screening. 7(5)

مصطلحات موضوعية: Library design, Models, Molecular, Genomic Library, Computer science, Organic Chemistry, Phosphotransferases, Molecular Conformation, Virtual space, Nanotechnology, General Medicine, Ligands, Data science, Design team, Computer Science Applications, Receptors, G-Protein-Coupled, Structure-Activity Relationship, Drug Design, Drug Discovery, Animals, Humans, Cluster analysis, Relevant information, Protein Kinase Inhibitors, Protein Kinases

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::adf07ce0131a554bc7da85d6d1d9d1eb
https://pubmed.ncbi.nlm.nih.gov/15320714

المؤلفون: Steven L. Dixon, Jianxin Duan, Woody Sherman, G. Madhavi Sastry, Jeffrey F. Lowrie

المصدر: Journal of Cheminformatics, Vol 3, Iss Suppl 1, p P1 (2011)
Journal of Cheminformatics

مصطلحات موضوعية: Virtual screening, Similarity (geometry), Database, lcsh:T58.5-58.64, Computer science, lcsh:Information technology, Specific-information, Fingerprint (computing), Library and Information Sciences, computer.software_genre, Computer Graphics and Computer-Aided Design, Computer Science Applications, lcsh:Chemistry, lcsh:QD1-999, Cheminformatics, Complementarity (molecular biology), Poster Presentation, Metric (mathematics), Pairwise comparison, Data mining, Physical and Theoretical Chemistry, computer

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::f6a485f48f94e4b90df2421d257cb280