111
TITLE: Mechanistic Pathway on Human alpha-Glucosidase Maltase-Glucoamylase Unveiled by QM/MM Calculations
AUTHORS: Bras, NF ; Santos Martins, D; Fernandes, PA ; Ramos, MJ ;
PUBLISHED: 2018, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY B, VOLUME: 122, ISSUE: 14
INDEXED IN: Scopus WOS CrossRef: 23
115
TITLE: Parametrization of Molybdenum Cofactors for the AMBER Force Field  Full Text
AUTHORS: Pedro Ferreira; Nuno M F S A Cerqueira ; Natercia F Bras ; Pedro A Fernandes ; Maria J Ramos ;
PUBLISHED: 2018, SOURCE: JOURNAL OF CHEMICAL THEORY AND COMPUTATION, VOLUME: 14, ISSUE: 5
INDEXED IN: Scopus WOS CrossRef: 8
116
TITLE: Properties that rank protein: protein docking poses with high accuracy  Full Text
AUTHORS: Simoes, ICM; Coimbra, JTS ; Neves, Rui P. P. ; Costa, IPD; Ramos, MJ ; Fernandes, PA ;
PUBLISHED: 2018, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 20, ISSUE: 32
INDEXED IN: Scopus WOS CrossRef: 7
117
TITLE: Protocol for Computational Enzymatic Reactivity Based on Geometry Optimisation  Full Text
AUTHORS: Cerqueira, NMFSA ; Fernandes, PA ; Ramos, MJ ;
PUBLISHED: 2018, SOURCE: CHEMPHYSCHEM, VOLUME: 19, ISSUE: 6
INDEXED IN: Scopus WOS CrossRef: 18
119
TITLE: Structure, Dynamics, and Energetics of ATP Hydrolysis by ABC Transporters
AUTHORS: Maria Joao Ramos ; Pedro Alexandrino Fernandes ;
PUBLISHED: 2018, SOURCE: ACS CENTRAL SCIENCE, VOLUME: 4, ISSUE: 10
INDEXED IN: Scopus WOS CrossRef: 1
120
TITLE: Studies on neuraminidase inhibition  Full Text
AUTHORS: Paiva, P ; Costa, IPD; Ferreira, CE; Ferreira, P; Pereira, AT; Cerqueira, NMFSA ; Fernandes, PA ; Ramos, MJ ;
PUBLISHED: 2018, SOURCE: INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, VOLUME: 118, ISSUE: 9
INDEXED IN: Scopus WOS CrossRef: 1
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