"Automation of the CHARMM General Force Field (CGenFF) II: Assignment of ..."

Kenno Vanommeslaeghe, E. Prabhu Raman, Alexander D. MacKerell Jr. (2012)

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DOI: 10.1021/CI3003649

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type: Journal Article

metadata version: 2020-03-06

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Kenno Vanommeslaeghe, E. Prabhu Raman, Alexander D. MacKerell Jr.:
Automation of the CHARMM General Force Field (CGenFF) II: Assignment of Bonded Parameters and Partial Atomic Charges. J. Chem. Inf. Model. 52(12): 3155-3168 (2012)

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