71
TITLE: Catalytic Mechanism of the Serine Hydroxymethyltransferase: A Computational ONIOM QM/MM Study
AUTHORS: Henrique S Fernandes ; Maria Joao Ramos ; Nuno M F S A Cerqueira ;
PUBLISHED: 2018, SOURCE: ACS CATALYSIS, VOLUME: 8, ISSUE: 11
INDEXED IN: Scopus WOS CrossRef: 31
IN MY: ORCID
72
TITLE: Determining the glycation site specificity of human holo-transferrin  Full Text
AUTHORS: Silva, AMN ; Joao T S Coimbra ; Maria M Castro; Angela Oliveira; Natercia F Bras ; Pedro A Fernandes ; Maria J Ramos ; Maria Rangel ;
PUBLISHED: 2018, SOURCE: 6th Georgian Bay International Conference on Bioinorganic Chemistry (CanBIC) in JOURNAL OF INORGANIC BIOCHEMISTRY, VOLUME: 186
INDEXED IN: Scopus WOS CrossRef: 3
IN MY: ORCID
73
TITLE: Mechanistic Insights on Human Phosphoglucomutase Revealed by Transition Path Sampling and Molecular Dynamics Calculations  Full Text
AUTHORS: Bras, NF ; Fernandes, PA ; Ramos, MJ ; Schwartz, SD;
PUBLISHED: 2018, SOURCE: CHEMISTRY-A EUROPEAN JOURNAL, VOLUME: 24, ISSUE: 8
INDEXED IN: Scopus WOS CrossRef: 9
IN MY: ORCID
74
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
IN MY: ORCID
78
TITLE: Modulation of lateral and longitudinal interdimeric interactions in microtubule models by Laulimalide and Peloruside A association: A molecular modeling approach on the mechanism of microtubule stabilizing agents  Full Text
AUTHORS: Matias A Zuniga; Joel B Alderete; Gonzalo A Jana; Pedro A Fernandez; Maria J Ramos ; Veronica A Jimenez;
PUBLISHED: 2018, SOURCE: CHEMICAL BIOLOGY & DRUG DESIGN, VOLUME: 91, ISSUE: 5
INDEXED IN: WOS
IN MY: ORCID
79
TITLE: Modulation of lateral and longitudinal interdimeric interactions in microtubule models by Laulimalide and Peloruside A association: A molecular modeling approach on the mechanism of microtubule stabilizing agents  Full Text
AUTHORS: Matías A Zúñiga; Joel B Alderete; Gonzalo A Jaña; Pedro A Fernandez; Maria J Ramos ; Verónica A Jiménez;
PUBLISHED: 2018, SOURCE: Chemical Biology & Drug Design, VOLUME: 91, ISSUE: 5
INDEXED IN: CrossRef: 7
IN MY: ORCID
80
TITLE: molUP: A VMD plugin to handle QM and ONIOM calculations using the gaussian software. A VMD Plugin to Handle QM and ONIOM Calculations
AUTHORS: Fernandes, HS ; Ramos, MJ ; Cerqueira, NMFSA ;
PUBLISHED: 2018, SOURCE: JOURNAL OF COMPUTATIONAL CHEMISTRY, VOLUME: 39, ISSUE: 19
INDEXED IN: Scopus WOS CrossRef
IN MY: ORCID
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