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3. Rapid Estimation of Catalytic Efficiency by Cumulative Atomic Multipole Moments: Application to Ketosteroid Isomerase Mutants. Beker W; van der Kamp MW; Mulholland AJ; Sokalski WA J Chem Theory Comput; 2017 Feb; 13(2):945-955. PubMed ID: 28103023 [TBL] [Abstract][Full Text] [Related]
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