New Soft-Core Potential Function for Molecular Dynamics Based Alchemical Free Energy Calculations
2012 | journal article
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Gapsys, Vytautas, Daniel Seeliger, and Bert L. de Groot. "New Soft-Core Potential Function for Molecular Dynamics Based Alchemical Free Energy Calculations." Journal of Chemical Theory and Computation, vol. 8, no. 7, 2012, pp. 2373-2382, doi: 10.1021/ct300220p.
