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TITLE: Solvent-accessible surface area: How well can be applied to hot-spot detection?. Solvent-Accessible Surface Area  Full Text
AUTHORS: Joao M Martins; Rui M Ramos ; Antonio C Pimenta; Irina S Moreira ;
PUBLISHED: 2014, SOURCE: PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS, VOLUME: 82, ISSUE: 3
INDEXED IN: Scopus WOS CrossRef: 22
IN MY: ORCID
12
TITLE: Structural features of the G-protein/GPCR interactions  Full Text
AUTHORS: Irina S Moreira ;
PUBLISHED: 2014, SOURCE: BIOCHIMICA ET BIOPHYSICA ACTA-GENERAL SUBJECTS, VOLUME: 1840, ISSUE: 1
INDEXED IN: Scopus WOS CrossRef
IN MY: ORCID
13
TITLE: Computational Alanine Scanning Mutagenesis-An Improved Methodological Approach for Protein-DNA Complexes  Full Text
AUTHORS: Rui M Ramos ; Irina S Moreira ;
PUBLISHED: 2013, SOURCE: JOURNAL OF CHEMICAL THEORY AND COMPUTATION, VOLUME: 9, ISSUE: 9
INDEXED IN: Scopus WOS CrossRef: 30
IN MY: ORCID
14
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
IN MY: ORCID
15
TITLE: Extending the applicability of the O-ring theory to protein-DNA complexes  Full Text
AUTHORS: Ramos, RM ; Fernandes, LF; Moreira, IS ;
PUBLISHED: 2013, SOURCE: COMPUTATIONAL BIOLOGY AND CHEMISTRY, VOLUME: 44
INDEXED IN: Scopus WOS CrossRef: 7
IN MY: ORCID
16
TITLE: Insights into the structural determinants for selective inhibition of nitric oxide synthase isoforms  Full Text
AUTHORS: Bruno L Oliveira; Irina S Moreira ; Pedro A Fernandes ; Maria J Ramos ; Isabel Santos; Joao D G Correia;
PUBLISHED: 2013, SOURCE: JOURNAL OF MOLECULAR MODELING, VOLUME: 19, ISSUE: 4
INDEXED IN: Scopus WOS CrossRef: 12
IN MY: ORCID
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TITLE: Ligand-Induced Structural Changes in TEM-1 Probed by Molecular Dynamics and Relative Binding Free Energy Calculations  Full Text
AUTHORS: Pimenta, AC; Martins, JM; Fernandes, R; Moreira, IS ;
PUBLISHED: 2013, SOURCE: JOURNAL OF CHEMICAL INFORMATION AND MODELING, VOLUME: 53, ISSUE: 10
INDEXED IN: Scopus WOS CrossRef
IN MY: ORCID
18
TITLE: Structural Determinants of a Typical Leucine-Rich Repeat Protein
AUTHORS: Joao M Martins; Rui M Ramos ; Irina S Moreira ;
PUBLISHED: 2013, SOURCE: COMMUNICATIONS IN COMPUTATIONAL PHYSICS, VOLUME: 13, ISSUE: 1
INDEXED IN: Scopus WOS CrossRef: 5
IN MY: ORCID
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TITLE: The Evolutionary Portrait of Metazoan NAD Salvage  Full Text
AUTHORS: Joao Carneiro ; Sara Duarte Pereira; Luisa Azevedo ; Filipe F C Castro ; Paulo Aguiar ; Irina S Moreira ; Amorim, Antonio ; Raquel M Silva ;
PUBLISHED: 2013, SOURCE: PLOS ONE, VOLUME: 8, ISSUE: 5
INDEXED IN: Scopus WOS CrossRef: 8
IN MY: ORCID
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TITLE: Theoretical studies on the binding of rhenium(I) complexes to inducible nitric oxide synthase  Full Text
AUTHORS: Bruno L Oliveira; Irina S Moreira ; Pedro A Fernandes ; Maria J Ramos ; Isabel Santos; Joao D G Correia;
PUBLISHED: 2013, SOURCE: JOURNAL OF MOLECULAR GRAPHICS & MODELLING, VOLUME: 45
INDEXED IN: Scopus WOS CrossRef: 12
IN MY: ORCID
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