81
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
82
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: 9
83
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: 41
84
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: 10
85
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
86
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: 21
88
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
89
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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