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Effect of set up protocols on the accuracy of alchemical free energy calculation over a set of ACK1 inhibitors (2018)

First Author: Granadino-Roldán J

Attributed to: EPSRC Flagship Software - BioSimSpace: A shared space for the community development of biomolecular simulation workflows funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1101/333120

Publication URI: http://dx.doi.org/10.1101/333120

Type: Preprint