Extracting Conformational Ensembles of Small Molecules from Molecular Dynamics Simulations: Ampicillin as a Test Case

Author： Malloci Giuliano   Serra Giovanni   Bosin Andrea   Vargiu Attilio Vittorio  

Publisher： MDPI

E-ISSN： 2079-3197|4|1|5-5

ISSN： 2079-3197

Source： Computation, Vol.4, Iss.1, 2016-01, pp. : 5-5

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