"Accelerating Alchemical Free Energy Prediction Using a Multistate Method: ..."

Candide Champion et al. (2023)

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DOI: 10.1021/ACS.JCIM.3C01469

access: closed

type: Journal Article

metadata version: 2024-01-13

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Candide Champion, René Gall, Benjamin Ries, Salomé Rieder, Emília P. Barros, Sereina Riniker:
Accelerating Alchemical Free Energy Prediction Using a Multistate Method: Application to Multiple Kinases. J. Chem. Inf. Model. 63(22): 7133-7147 (2023)

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