"A novel method for calculating relative free energy of similar molecules ..."

Asaf Farhi, Bipin Singh (2017)

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DOI: 10.1016/J.CPC.2016.10.022

access: closed

type: Journal Article

metadata version: 2020-10-26

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Asaf Farhi, Bipin Singh:
A novel method for calculating relative free energy of similar molecules in two environments. Comput. Phys. Commun. 212: 132-145 (2017)

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