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DFFR: A New Method for High-Throughput Recalibration of Automatic Force-Fields for Drugs.

Moreno D, Zivanovic S, Colizzi F, Hospital A, Aranda J, Soliva R, Orozco M. DFFR: A New Method for High-Throughput Recalibration of Automatic Force-Fields for Drugs. J Chem Theory Comput. 2020 Oct 13; 16(10):6598-6608.

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