Open AccessDevelopment of computational tools to enhance the study of catalytic mechanisms
Author(s) -
Nuno M. F. S. A. Cerqueira,
Henrique S. Fernandes,
Maria J. Ramos
Publication year - 2017
Language(s) - English
Resource type - Conference proceedings
DOI - 10.3390/mol2net-03-05073
Subject(s) - oniom , serine hydroxymethyltransferase , qm/mm , gaussian , chemistry , computer science , gaussian elimination , computational chemistry , computational science , catalysis , serine , enzyme , molecular dynamics , organic chemistry
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