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Understanding structure-activity relationships for trypanosomal cysteine protease inhibitors by simulations and free energy calculations
Santos, Lucianna H, Waldner, Birgit J., Fuchs, Julian E., Pereira, Glaécia AN, Liedl, Klaus R., Caffarena, Ernesto, Ferreira, Rafaela S.Language:
english
Journal:
Journal of Chemical Information and Modeling
DOI:
10.1021/acs.jcim.8b00557
Date:
December, 2018
File:
PDF, 1.07 MB
english, 2018