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Journal Articles Journal of Chemical Theory and Computation Year : 2014

GEM*: A Molecular Electronic Density--Based Force Field for Classical Molecular Dynamics Simulations

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hal-01287209 , version 1 (12-03-2016)

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R. Duke, O. Starovoytov, J.-P. Piquemal, G. A. Cisneros. GEM*: A Molecular Electronic Density--Based Force Field for Classical Molecular Dynamics Simulations . Journal of Chemical Theory and Computation, 2014, 10, pp.1361-1365. ⟨10.1021/ct500050p⟩. ⟨hal-01287209⟩
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