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Rapid Estimation of Catalytic Efficiency by Cumulative Atomic Multipole Moments: Application to Ketosteroid Isomerase Mutants
Beker, Wiktor, van der Kamp, Marc W., Mulholland, Adrian J., Sokalski, W. AndrzejVolume:
13
Language:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/acs.jctc.6b01131
Date:
February, 2017
File:
PDF, 2.08 MB
english, 2017