"VAD-MM/GBSA: A Variable Atomic Dielectric MM/GBSA Model for Improved ..."

Ercheng Wang et al. (2021)

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DOI: 10.1021/ACS.JCIM.1C00091

access: closed

type: Journal Article

metadata version: 2025-03-03

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Ercheng Wang, Weitao Fu, Dejun Jiang, Huiyong Sun, Junmei Wang, Xujun Zhang, Gaoqi Weng, Hui Liu, Peng Tao, Tingjun Hou:
VAD-MM/GBSA: A Variable Atomic Dielectric MM/GBSA Model for Improved Accuracy in Protein-Ligand Binding Free Energy Calculations. J. Chem. Inf. Model. 61(6): 2844-2856 (2021)

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