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1دورية أكاديمية
المؤلفون: Chaofeng Lou, Hongbin Yang, Hua Deng, Mengting Huang, Weihua Li, Guixia Liu, Philip W. Lee, Yun Tang
المصدر: Journal of Cheminformatics, Vol 15, Iss 1, Pp 1-14 (2023)
مصطلحات موضوعية: Mutagenicity optimization, Lead optimization, Matched molecular pairs analysis, Machine learning, Consensus model, Information technology, T58.5-58.64, Chemistry, QD1-999
وصف الملف: electronic resource
Relation: https://doaj.org/toc/1758-2946
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2دورية أكاديمية
المؤلفون: Mengting Huang, Chaofeng Lou, Zengrui Wu, Weihua Li, Philip W. Lee, Yun Tang, Guixia Liu
المصدر: Journal of Cheminformatics, Vol 14, Iss 1, Pp 1-16 (2022)
مصطلحات موضوعية: UDP-glucuronosyltransferases, Enzyme, Drug metabolism, Glucuronidation, Phase II metabolism, Graph neural network, Information technology, T58.5-58.64, Chemistry, QD1-999
وصف الملف: electronic resource
Relation: https://doaj.org/toc/1758-2946
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3
المؤلفون: Zhong Li, Xusheng Shao, Philip W. Lee, Xuhong Qian
المصدر: Journal of Agricultural and Food Chemistry. 71:5417-5418
مصطلحات موضوعية: General Chemistry, General Agricultural and Biological Sciences
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4
المؤلفون: Chaofeng Lou, Hongbin Yang, Hua Deng, Mengting Huang, Weihua Li, Guixia Liu, Philip W. Lee, Yun Tang
مصطلحات موضوعية: Library and Information Sciences, Physical and Theoretical Chemistry, Computer Graphics and Computer-Aided Design, Computer Science Applications
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::c1eae41bd62195fb63a092cfba55e54d
https://doi.org/10.21203/rs.3.rs-2261460/v1 -
5
المؤلفون: Chaofeng Lou, Hongbin Yang, Jiye Wang, Mengting Huang, Weihua Li, Guixia Liu, Philip W. Lee, Yun Tang
المصدر: Journal of chemical information and modeling. 62(11)
مصطلحات موضوعية: Deep Learning, General Chemical Engineering, Chemistry, Pharmaceutical, Humans, General Chemistry, Blood Proteins, Library and Information Sciences, Computer Science Applications, Protein Binding
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6
المؤلفون: Yun Tang, Weihua Li, Hongbin Yang, Guixia Liu, Philip W. Lee, Yingchun Cai
المصدر: Journal of Chemical Information and Modeling. 58:1169-1181
مصطلحات موضوعية: 0301 basic medicine, Hydrolases, General Chemical Engineering, Computational biology, Library and Information Sciences, 010402 general chemistry, Models, Biological, 01 natural sciences, Redox, Enzyme catalysis, Machine Learning, 03 medical and health sciences, Animals, Humans, Computer Simulation, KEGG, Artificial neural network, Chemistry, External validation, Oxidation reduction, General Chemistry, 0104 chemical sciences, Computer Science Applications, 030104 developmental biology, Pharmaceutical Preparations, Biocatalysis, Neural Networks, Computer, Oxidoreductases, Oxidation-Reduction, Drug metabolism
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7
المؤلفون: Qianqian Cao, Yingchun Cai, Lixia Sun, Philip W. Lee, Guixia Liu, Hongbin Yang, Lin Liu, Zhuang Wang, Weihua Li, Yun Tang
مصطلحات موضوعية: Prioritization, 0303 health sciences, biology, business.industry, Health, Toxicology and Mutagenesis, In silico, 010501 environmental sciences, Toxicology, Machine learning, computer.software_genre, biology.organism_classification, 01 natural sciences, Aquatic toxicology, Environmental hazard, 03 medical and health sciences, Chemistry, Molecular descriptor, Environmental science, Mysidae, Artificial intelligence, business, computer, 030304 developmental biology, 0105 earth and related environmental sciences
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::552acd8292ea78a6bf831fede96ee5f9
https://europepmc.org/articles/PMC6505403/ -
8
المؤلفون: Hongbin Yang, Guixia Liu, Weihua Li, Yingchun Cai, Philip W. Lee, Yun Tang
المصدر: Journal of chemical information and modeling. 59(3)
مصطلحات موضوعية: Binding Sites, 010304 chemical physics, Drug discovery, General Chemical Engineering, In silico, Computational Biology, Feature selection, General Chemistry, Metabolism, Computational biology, Library and Information Sciences, Data imbalance, 01 natural sciences, 0104 chemical sciences, Computer Science Applications, Machine Learning, 010404 medicinal & biomolecular chemistry, chemistry.chemical_compound, Metabolic pathway, chemistry, Resampling, 0103 physical sciences, Biocatalysis, Glucuronosyltransferase, Xenobiotic
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9
المؤلفون: Chen Zhang, Guixia Liu, Weihua Li, Wenjie Wu, Philip W. Lee, Shikai Gu, Changming Liu, Yuan Zhou, Kaidong Wang, Yun Tang, Zengrui Wu
المصدر: Toxicology Research. 5:570-582
مصطلحات موضوعية: 0301 basic medicine, biology, Computer science, Drug discovery, Health, Toxicology and Mutagenesis, In silico, hERG, Computational biology, Toxicology, Bioinformatics, Potassium channel, Support vector machine, 03 medical and health sciences, 030104 developmental biology, Binary classification, Molecular descriptor, Test set, biology.protein
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::2f269963b093b529ebde26c4845a1efd
https://doi.org/10.1039/c5tx00294j -
10
المؤلفون: Guixia Liu, Philip W. Lee, Weihua Li, Hongbin Yang, Qianqian Cao, Lin Liu, Yingchun Cai, Yun Tang
المصدر: Environmental science. Processesimpacts. 20(9)
مصطلحات موضوعية: 0301 basic medicine, In silico, 010501 environmental sciences, Management, Monitoring, Policy and Law, 01 natural sciences, Aquatic toxicology, Environmental hazard, Set (abstract data type), Machine Learning, 03 medical and health sciences, Environmental Chemistry, Animals, Humans, Environmental impact assessment, Computer Simulation, 0105 earth and related environmental sciences, Aquatic ecosystem, Fingerprint (computing), Public Health, Environmental and Occupational Health, General Medicine, Models, Theoretical, Support vector machine, 030104 developmental biology, Daphnia, Environmental science, Biochemical engineering, Algorithms, Water Pollutants, Chemical
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::9f8f67c894d1a9a34bb62347895bbed7
https://pubmed.ncbi.nlm.nih.gov/30069560