Large-Scale Docking in the Cloud-Reference-Cited by-同舟云学术

Large-Scale Docking in the Cloud

Published:2023-04-18 Issue:9 Volume:63 Page:2735-2741
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Tingle Benjamin I.¹,Irwin John J.¹^ORCID

Affiliation:

1. Department of Pharmaceutical Chemistry, University of California San Francisco, 1700 4th Street, MC 2550, San Francisco, California 94158-2330, United States

Funder

National Institute of General Medical Sciences

Publisher

American Chemical Society (ACS)

Subject

Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.3c00031

Reference21 articles.

1. Ultra-large library docking for discovering new chemotypes

2. Artificial intelligence–enabled virtual screening of ultra-large chemical libraries with deep docking

3. Virtual discovery of melatonin receptor ligands to modulate circadian rhythms

4. An open-source drug discovery platform enables ultra-large virtual screens

5. Structure-Based Virtual Screening of Ultra-Large Library Yields Potent Antagonists for a Lipid GPCR

Cited by 10 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. Identifying Artifacts from Large Library Docking;Journal of Medicinal Chemistry;2024-09-10

2. Perspectives on current approaches to virtual screening in drug discovery;Expert Opinion on Drug Discovery;2024-08-12

3. Identifying Artifacts from Large Library Docking;2024-07-18

4. SchNetPack Hyperparameter Optimization for a More Reliable Top Docking Scores Prediction;The Journal of Physical Chemistry B;2024-05-11

5. Drugging the entire human proteome: Are we there yet?;Drug Discovery Today;2024-03