"Solvent Interaction Energy Calculations on Molecular Dynamics ..."

Markus A. Lill, Jared J. Thompson (2011)

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DOI: 10.1021/CI200191M

access: closed

type: Journal Article

metadata version: 2020-06-15

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Markus A. Lill, Jared J. Thompson:
Solvent Interaction Energy Calculations on Molecular Dynamics Trajectories: Increasing the Efficiency Using Systematic Frame Selection. J. Chem. Inf. Model. 51(10): 2680-2689 (2011)

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