121
TITLE: Molecular dynamics analysis of a series of 22 potential farnesyltransferase substrates containing a CaaX-motif  Full Text
AUTHORS: Sérgio F. Sousa ; Joao T S Coimbra ; Diogo Paramos; Rita Pinto; Rodrigo S Guimares; Vitor Teixeira; Pedro A Fernandes ; Maria J Ramos ;
PUBLISHED: 2013, SOURCE: JOURNAL OF MOLECULAR MODELING, VOLUME: 19, ISSUE: 2
INDEXED IN: Scopus WOS CrossRef: 11
122
TITLE: Parameters for Molecular Dynamics Simulations of Manganese-Containing Metalloproteins  Full Text
AUTHORS: Neves, Rui P. P. ; Sérgio F. Sousa ; Pedro A Fernandes ; Maria J Ramos ;
PUBLISHED: 2013, SOURCE: JOURNAL OF CHEMICAL THEORY AND COMPUTATION, VOLUME: 9, ISSUE: 6
INDEXED IN: Scopus WOS CrossRef: 37
123
124
TITLE: Chemically Modified Tetracyclines as Inhibitors of MMP-2 Matrix Metalloproteinase: A Molecular and Structural Study
AUTHORS: Bruna L Marcial; Sérgio F. Sousa ; Ingrid L Barbosa; Helio F Dos Santos; Maria J Ramos ;
PUBLISHED: 2012, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY B, VOLUME: 116, ISSUE: 46
INDEXED IN: Scopus WOS CrossRef: 32
125
TITLE: Computational enzymatic catalysis - clarifying enzymatic mechanisms with the help of computers  Full Text
AUTHORS: Sérgio F. Sousa ; Pedro Alexandrino Fernandes ; Maria Joao Ramos ;
PUBLISHED: 2012, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 14, ISSUE: 36
INDEXED IN: Scopus WOS CrossRef: 53
126
TITLE: Decomplexation and complexation of alkali metal cations by a crown-ether-type podand in dichloromethane: a steered molecular dynamics study  Full Text
AUTHORS: Mario Valente; Sérgio F. Sousa ; Magalhaes, AL ; cristina freire ;
PUBLISHED: 2012, SOURCE: THEORETICAL CHEMISTRY ACCOUNTS, VOLUME: 131, ISSUE: 3
INDEXED IN: Scopus WOS CrossRef: 4
129
TITLE: Transfer of the K+ Cation Across a Water/Dichloromethane Interface: A Steered Molecular Dynamics Study with Implications in Cation Extraction
AUTHORS: Mario Valente; Sérgio F. Sousa ; Magalhaes, AL ; cristina freire ;
PUBLISHED: 2012, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY B, VOLUME: 116, ISSUE: 6
INDEXED IN: Scopus WOS CrossRef: 9
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