"Virtual screening of integrase inhibitors by large scale binding free ..."

Emilio Gallicchio et al. (2014)

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DOI: 10.1007/S10822-014-9711-9

access: closed

type: Journal Article

metadata version: 2020-04-16

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Emilio Gallicchio, Nan-Jie Deng, Peng He, Lauren Wickstrom, Alexander L. Perryman, Daniel N. Santiago, Stefano Forli, Arthur J. Olson, Ronald M. Levy:
Virtual screening of integrase inhibitors by large scale binding free energy calculations: the SAMPL4 challenge. J. Comput. Aided Mol. Des. 28(4): 475-490 (2014)

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