Integrating QSAR modelling and deep learning in drug discovery: the emergence of deep QSAR
Author:
Publisher
Springer Science and Business Media LLC
Subject
Drug Discovery,Pharmacology,General Medicine
Link
https://www.nature.com/articles/s41573-023-00832-0.pdf
Reference163 articles.
1. Hansch, C., Maloney, P., Fujita, T. & Muir, R. Correlation of biological activity of phenoxyacetic acids with hammett substituent constants and partition coefficients. Nature 194, 178–180 (1962).
2. Cherkasov, A. et al. QSAR modeling: where have you been? Where are you going to? J. Med. Chem. 57, 4977–5010 (2014).
3. Muratov, E. N. et al. QSAR without borders. Chem. Soc. Rev. 49, 3525–3564 (2020).
4. Ivakhnenko, A. G. & Lapa, V. G. Cybernetics and Forecasting Techniques (American Elsevier Co, 1967).
5. Ma, J., Sheridan, R. P., Liaw, A., Dahl, G. E. & Svetnik, V. Deep neural nets as a method for quantitative structure-activity relationships. J. Chem. Inf. Model. 55, 263–274 (2015).
Cited by 31 articles. 订阅此论文施引文献 订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献
1. Investigation of in silico studies for cytochrome P450 isoforms specificity;Computational and Structural Biotechnology Journal;2024-12
2. Natural product databases for drug discovery: Features and applications;Pharmaceutical Science Advances;2024-12
3. From roots to codes: Applications of computer-aided drug discovery from medicinal plants;South African Journal of Botany;2024-10
4. The role of artificial intelligence in the development of anticancer therapeutics from natural polyphenols: Current advances and future prospects;Pharmacological Research;2024-10
5. Quantum Computing;Advances in Medical Technologies and Clinical Practice;2024-09-27
1.学者识别学者识别
2.学术分析学术分析
3.人才评估人才评估
"同舟云学术"是以全球学者为主线，采集、加工和组织学术论文而形成的新型学术文献查询和分析系统，可以对全球学者进行文献检索和人才价值评估。用户可以通过关注某些学科领域的顶尖人物而持续追踪该领域的学科进展和研究前沿。经过近期的数据扩容，当前同舟云学术共收录了国内外主流学术期刊6万余种，收集的期刊论文及会议论文总量共计约1.5亿篇，并以每天添加12000余篇中外论文的速度递增。我们也可以为用户提供个性化、定制化的学者数据。欢迎来电咨询！咨询电话：010-8811{复制后删除}0370
www.globalauthorid.com
TOP
Copyright © 2019-2024 北京同舟云网络信息技术有限公司 京公网安备11010802033243号 京ICP备18003416号-3