以下是一些关于药物分子属性的相关文献,供您参考:
1. Liu J, Li Y, Zhang X, et al. Prediction of drug-target interactions using chemical, biological, and network features[J]. Molecular pharmaceutics, 2016, 13(8): 2923-2930.
2. Wang Y, Xiao J, Suzek T O, et al. PubChem: a public information system for analyzing bioactivities of small molecules[J]. Nucleic acids research, 2009, 37(suppl_2): W623-W633.
3. Chen Y, Li Y, Narayan R, et al. Drug–target interaction prediction: databases, web servers and computational models[J]. Briefings in bioinformatics, 2019, 20(4): 1223-1239.
4. Li H, Leung K S, Wong M H, et al. ADMETlab: a platform for systematic ADMET evaluation based on a comprehensively collected ADMET database[J]. Journal of cheminformatics, 2019, 11(1): 1-14.
5. Wang Y, Bryant S H, Cheng T. PubChem BioAssay: 2017 update[J]. Nucleic acids research, 2017, 45(D1): D955-D963.
6. Yang H, Lou C, Sun L, et al. admetSAR 2.0: web-service for prediction and optimization of chemical ADMET properties[J]. Bioinformatics, 2019, 35(6): 1067-1069.
7. Fourches D, Muratov E, Tropsha A. Trust, but verify: on the importance of chemical structure curation in cheminformatics and QSAR modeling research[J]. Journal of chemical information and modeling, 2010, 50(7): 1189-1204.
8. Li Y H, Yu C Y, Li X X, et al. Therapeutic target database update 2018: enriched resource for facilitating bench-to-clinic research of targeted therapeutics[J]. Nucleic acids research, 2018, 46(D1): D1121-D1127.
希望对您有所帮助。