AutoDock Vina 1.2.0: New Docking Methods, Expanded Force Field, and Python Bindings
Author:
Affiliation:
1. Department of Integrative Structural and Computational Biology, Scripps Research, La Jolla, 92037 California, 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.1c00203
Reference56 articles.
1. AutoDock Vina: Improving the speed and accuracy of docking with a new scoring function, efficient optimization, and multithreading
2. Computational protein–ligand docking and virtual drug screening with the AutoDock suite
3. A semiempirical free energy force field with charge-based desolvation
4. Accelerating AutoDock4 with GPUs and Gradient-Based Local Search
5. AutoDockFR: Advances in Protein-Ligand Docking with Explicitly Specified Binding Site Flexibility
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