المؤلفون: Mei Wen, Zhen-ke Deng, Shi-long Jiang, Yi-di Guan, Hai-zhou Wu, Xin-luan Wang, Song-shu Xiao, Yi Zhang, Jin-ming Yang, Dong-sheng Cao, Yan Cheng

المصدر: Frontiers in Pharmacology, Vol 10 (2019)

مصطلحات موضوعية: Bcl-2, small molecule inhibitors, breast cancer cell, virtual screening, QSAR, Therapeutics. Pharmacology, RM1-950

وصف الملف: electronic resource

Relation: https://www.frontiersin.org/article/10.3389/fphar.2019.00391/full; https://doaj.org/toc/1663-9812

URL الوصول: https://doaj.org/article/caf8e622526f42f8a8545e011a67fb92

المؤلفون: Yong-Huan Yun, Wen-Qun Li, Wen-Ling Ye, Alex F. Chen, Jin-Wei Zhang, Su-Qing Yang, Lin Zhang, Liu-Xia Zhang, Dong-Sheng Cao, Zhen-Ke Deng

المصدر: Chemometrics and Intelligent Laboratory Systems. 185:32-40

مصطلحات موضوعية: 0303 health sciences, Quantitative structure–activity relationship, Virtual screening, Chemistry, Kinase, Process Chemistry and Technology, 010401 analytical chemistry, Computational biology, Ligand (biochemistry), 01 natural sciences, 0104 chemical sciences, Computer Science Applications, Analytical Chemistry, 03 medical and health sciences, Docking (molecular), Pharmacophore, Receptor, Spectroscopy, Software, 030304 developmental biology, G protein-coupled receptor

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::9ddb37b7f55c2fd339a20f694a1451be
https://doi.org/10.1016/j.chemolab.2018.12.015

المؤلفون: Jie Dong, Chen Huang, Min-Feng Zhu, Aiping Lu, Zhi-Jiang Yao, Ning-Ning Wang, Qi Mi, Alex F. Chen, Dong-Sheng Cao, Zhen-Ke Deng

المصدر: Chemometrics and Intelligent Laboratory Systems. 170:84-95

مصطلحات موضوعية: 0301 basic medicine, Boosting (machine learning), Computer science, Process Chemistry and Technology, 010401 analytical chemistry, computer.software_genre, 01 natural sciences, 0104 chemical sciences, Computer Science Applications, Analytical Chemistry, Random forest, Support vector machine, 03 medical and health sciences, symbols.namesake, 030104 developmental biology, Drug development, Robustness (computer science), Test set, symbols, Data mining, Gaussian process, computer, Spectroscopy, Software, ADME

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::3c3d2911fbfa1706ced7e1ffcc658cc5
https://doi.org/10.1016/j.chemolab.2017.09.005

المؤلفون: Chen Huang, Ben Lv, Min-Feng Zhu, Aiping Lu, Jie Dong, Alex F. Chen, Ning-Ning Wang, Dong-Sheng Cao, Zhen-Ke Deng, Zhi-Jiang Yao

المصدر: RSC Advances. 7:19007-19018

مصطلحات موضوعية: 0301 basic medicine, Virtual screening, Computer science, General Chemical Engineering, General Chemistry, computer.software_genre, Random forest, 03 medical and health sciences, 030104 developmental biology, Application domain, Test set, Human intestinal absorption, Data mining, Unbalanced data, Representation (mathematics), computer, Applicability domain

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::42fb92a6de388eaa676dfcbb08ccaa2e
https://doi.org/10.1039/c6ra28442f

المؤلفون: Jin-Wei Zhang, Defang Ouyang, Dong-Sheng Cao, Zhen-Ke Deng, Yan Cheng, Lu Liu, Qian Cao, Wen-Ling Ye, Lin Zhang, Li Fu, Hui Wei

المصدر: Molecular pharmaceutics. 16(1)

مصطلحات موضوعية: medicine.medical_specialty, Drug-Related Side Effects and Adverse Reactions, Pharmaceutical Science, 02 engineering and technology, Prediction system, 030226 pharmacology & pharmacy, Gastroenterology, Risk Assessment, Three level, Machine Learning, 03 medical and health sciences, 0302 clinical medicine, Internal medicine, Drug Discovery, Medicine, Humans, End point, Receiver operating characteristic, business.industry, Models, Theoretical, 021001 nanoscience & nanotechnology, Liver, Area Under Curve, Molecular Medicine, Chemical and Drug Induced Liver Injury, 0210 nano-technology, business, Algorithms

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::318344f99c41e092322af251cf7aa670
https://pubmed.ncbi.nlm.nih.gov/30475633

المؤلفون: Zhi-Jiang Yao, Jie Dong, Min-Feng Zhu, Dong-Sheng Cao, Zhen-Ke Deng, Rui-Gang Zhao

المصدر: Journal of Chemometrics. 31:e2922

مصطلحات موضوعية: 0301 basic medicine, Quantitative structure–activity relationship, Ensemble forecasting, Computer science, business.industry, Applied Mathematics, 010401 analytical chemistry, Stability (learning theory), Pattern recognition, Feature selection, 01 natural sciences, Ensemble learning, 0104 chemical sciences, Analytical Chemistry, 03 medical and health sciences, 030104 developmental biology, Outlier, Partial least squares regression, Artificial intelligence, business, Applicability domain

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::c64784cd7604aad2d0c1d52721ae6b58
https://doi.org/10.1002/cem.2922