Evaluation of Force-Field Calculations of Lattice Energies on a Large Public Dataset, Assessment of Pharmaceutical Relevance, and Comparison to Density Functional Theory
Marchese Robinson, Richard L, Geatches, Dawn, Morris, Chris, Mackenzie, Rebecca, Maloney, Andrew G. P, Roberts, Kevin J, Moldovan, Alexandru, Chow, Ernest, Pencheva, Klimentina, Vatvani, Dinesh Ramesh Mirpuri
Published in Journal of chemical information and modeling (25.11.2019)
Published in Journal of chemical information and modeling (25.11.2019)
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