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Accelerating AutoDock4 with GPUs and Gradient-Based Local Search.
Santos-Martins D, Solis-Vasquez L, Tillack AF, Sanner MF, Koch A, Forli S. Santos-Martins D, et al. Among authors: sanner mf. J Chem Theory Comput. 2021 Feb 9;17(2):1060-1073. doi: 10.1021/acs.jctc.0c01006. Epub 2021 Jan 6. J Chem Theory Comput. 2021. PMID: 33403848 Free PMC article.
The AutoDock suite at 30.
Goodsell DS, Sanner MF, Olson AJ, Forli S. Goodsell DS, et al. Among authors: sanner mf. Protein Sci. 2021 Jan;30(1):31-43. doi: 10.1002/pro.3934. Epub 2020 Sep 12. Protein Sci. 2021. PMID: 32808340 Free PMC article.
Docking Flexible Cyclic Peptides with AutoDock CrankPep.
Zhang Y, Sanner MF. Zhang Y, et al. Among authors: sanner mf. J Chem Theory Comput. 2019 Oct 8;15(10):5161-5168. doi: 10.1021/acs.jctc.9b00557. Epub 2019 Sep 17. J Chem Theory Comput. 2019. PMID: 31505931 Free PMC article.
90 results