101
TITLE: Bases azotadas
AUTHORS: Sérgio F. Sousa ;
PUBLISHED: 2014, SOURCE: Revista de Ciência Elementar, VOLUME: 2, ISSUE: 3
INDEXED IN: CrossRef
102
TITLE: Biomembrane simulations of 12 lipid types using the general amber force field in a tensionless ensemble
AUTHORS: Joao T S Coimbra ; Sérgio F. Sousa ; Pedro A Fernandes ; Maria Rangel ; Maria J Ramos ;
PUBLISHED: 2014, SOURCE: JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, VOLUME: 32, ISSUE: 1
INDEXED IN: Scopus WOS CrossRef: 9
104
TITLE: Enzymatic "Tricks": Carboxylate Shift and Sulfur Shift  Full Text
AUTHORS: Sérgio F. Sousa ; Nuno M F S A Cerqueira ; Natercia F Bras ; Pedro A Fernandes ; Maria J Ramos ;
PUBLISHED: 2014, SOURCE: INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, VOLUME: 114, ISSUE: 19
INDEXED IN: Scopus WOS CrossRef: 12
105
TITLE: Prediction of Solvation Free Energies with Thermodynamic Integration Using the General Amber Force Field  Full Text
AUTHORS: Silvia A Martins; Sérgio F. Sousa ; Maria Joao Ramos ; Pedro A Fernandes ;
PUBLISHED: 2014, SOURCE: JOURNAL OF CHEMICAL THEORY AND COMPUTATION, VOLUME: 10, ISSUE: 8
INDEXED IN: Scopus WOS CrossRef: 31
106
TITLE: Protein ligand docking in drug discovery
AUTHORS: Bras, NF ; Cerqueira, NMFSA ; Sérgio F. Sousa ; Fernandes, PA ; Ramos, MJ ;
PUBLISHED: 2014, SOURCE: Protein Modelling, VOLUME: 9783319099767
INDEXED IN: Scopus CrossRef
107
TITLE: Structural and dynamics analysis of matrix metalloproteinases MMP-2 complexed with chemically modified tetracyclines (CMTs)
AUTHORS: Marcial, BL; Sérgio F. Sousa ; Dos Santos, HF; Ramos, MJ ;
PUBLISHED: 2014, SOURCE: JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, VOLUME: 32, ISSUE: 12
INDEXED IN: Scopus WOS CrossRef: 6
109
TITLE: Comparative assessment of computational methods for the determination of solvation free energies in alcohol-based molecules  Full Text
AUTHORS: Silvia A Martins; Sérgio F. Sousa ;
PUBLISHED: 2013, SOURCE: JOURNAL OF COMPUTATIONAL CHEMISTRY, VOLUME: 34, ISSUE: 15
INDEXED IN: Scopus WOS CrossRef: 19
110
TITLE: Computational Alanine Scanning Mutagenesis: MM-PBSA vs TI  Full Text
AUTHORS: Silvia A Martins; Marta A S Perez; Irina S Moreira ; Sérgio F. Sousa ; Ramos, MJ ; Fernandes, PA ;
PUBLISHED: 2013, SOURCE: JOURNAL OF CHEMICAL THEORY AND COMPUTATION, VOLUME: 9, ISSUE: 3
INDEXED IN: Scopus WOS CrossRef: 61
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