BRIDGE: An Open Platform for Reproducible High-Throughput Free Energy Simulations

Tharindu Senapathi, Miroslav Suruzhon, Christopher B. Barnett, Jonathan W. Essex, Kevin J. Naidoo. BRIDGE: An Open Platform for Reproducible High-Throughput Free Energy Simulations. Journal of Chemical Information and Computer Sciences, 60(11):5290-5295, 2020. [doi]

Abstract

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