Using AlphaFold and Experimental Structures for the Prediction of the Structure and Binding Affinities of GPCR Complexes via Induced Fit Docking and Free Energy Perturbation

发表于 2026-8-10 16:13:04

期刊：Journal of Chemical Theory and Computation

文献作者：Dilek Coskun; Muyun Lihan; Joao P. G. L. M. Rodrigues; Márton Vass; Daniel Robinson; Richard A. Friesner; Edward B. Miller

出版日期：2024-1-9

DOI号：10.1021/acs.jctc.3c00839

下载链接：https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.3c00839

文献链接：https://doi.org/10.1021/acs.jctc.3c00839

当前文献来源于 American Chemical Society (ACS)。

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[ACS] Using AlphaFold and Experimental Structures for the Prediction of the Structure and Binding Affinities of GPCR Complexes via Induced Fit Docking and Free Energy Perturbation

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