241
TITLE: Structural feature study of benzofuran derivatives as farnesyltransferase inhibitors  Full Text
AUTHORS: Hari Narayana H N Moorthy ; Sérgio F. Sousa ; Maria J Ramos ; Pedro A Fernandes ;
PUBLISHED: 2011, SOURCE: JOURNAL OF ENZYME INHIBITION AND MEDICINAL CHEMISTRY, VOLUME: 26, ISSUE: 6
INDEXED IN: Scopus WOS CrossRef: 17
IN MY: ORCID
242
TITLE: The Accuracy of Density Functional Theory in the Description of Cation-pi and pi-Hydrogen Bond Interactions  Full Text
AUTHORS: Ana Rute Neves; Pedro Alexandrino Fernandes ; Maria Joao Ramos ;
PUBLISHED: 2011, SOURCE: JOURNAL OF CHEMICAL THEORY AND COMPUTATION, VOLUME: 7, ISSUE: 7
INDEXED IN: Scopus WOS CrossRef: 37
IN MY: ORCID
243
TITLE: The Catalytic Mechanism of RNA Polymerase II  Full Text
AUTHORS: Alexandra T P Carvalho; Pedro A Fernandes ; Maria J Ramos ;
PUBLISHED: 2011, SOURCE: JOURNAL OF CHEMICAL THEORY AND COMPUTATION, VOLUME: 7, ISSUE: 4
INDEXED IN: Scopus WOS CrossRef: 39
IN MY: ORCID
244
TITLE: Theoretical insights into the catalytic mechanism of beta-hexosaminidase  Full Text
AUTHORS: Oscar Passos; Pedro Alexandrino Fernandes ; Maria Joao Ramos ;
PUBLISHED: 2011, SOURCE: THEORETICAL CHEMISTRY ACCOUNTS, VOLUME: 129, ISSUE: 1
INDEXED IN: Scopus WOS CrossRef: 12
IN MY: ORCID
245
TITLE: Topological, hydrophobicity, and other descriptors on alpha-glucosidase inhibition: a QSAR study on xanthone derivatives  Full Text
AUTHORS: Moorthy, NSHN ; Ramos, MJ ; Fernandes, PA ;
PUBLISHED: 2011, SOURCE: JOURNAL OF ENZYME INHIBITION AND MEDICINAL CHEMISTRY, VOLUME: 26, ISSUE: 6
INDEXED IN: Scopus WOS CrossRef: 11
IN MY: ORCID
246
TITLE: vsLab-An Implementation for Virtual High-Throughput Screening Using AutoDock and VMD  Full Text
AUTHORS: Cerqueira, NMFSA ; Ribeiro, J; Fernandes, PA ; Ramos, MJ ;
PUBLISHED: 2011, SOURCE: 4th International Theoretical Biophysics Symposium in INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, VOLUME: 111, ISSUE: 6
INDEXED IN: Scopus WOS CrossRef: 28
IN MY: ORCID
247
TITLE: Benchmarking of DFT Functionals for the Hydrolysis of Phosphodiester Bonds  Full Text
AUTHORS: Antonio J M Ribeiro ; Maria J Ramos ; Pedro A Fernandes ;
PUBLISHED: 2010, SOURCE: JOURNAL OF CHEMICAL THEORY AND COMPUTATION, VOLUME: 6, ISSUE: 8
INDEXED IN: Scopus WOS CrossRef: 67
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248
TITLE: DFT studies on the beta-glycosidase catalytic mechanism: The deglycosylation step  Full Text
AUTHORS: Natercia F Bras ; Maria J Ramos ; Pedro A Fernandes ;
PUBLISHED: 2010, SOURCE: 9th National Meeting of Physical Chemistry in JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, VOLUME: 946, ISSUE: 1-3
INDEXED IN: Scopus WOS CrossRef: 21
IN MY: ORCID
249
TITLE: Glutathione Transferase A1-1: Catalytic Importance of Arginine 15
AUTHORS: Daniel F A R Dourado; Pedro Alexandrino Fernandes ; Bengt Mannervik; Maria Joao Ramos ;
PUBLISHED: 2010, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY B, VOLUME: 114, ISSUE: 4
INDEXED IN: Scopus WOS CrossRef: 17
IN MY: ORCID
250
TITLE: Glutathione Transferase Classes Alpha, Pi, and Mu: GSH Activation Mechanism
AUTHORS: Daniel F A R Dourado; Pedro Alexandrino Fernandes ; Maria Joao Ramos ;
PUBLISHED: 2010, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY B, VOLUME: 114, ISSUE: 40
INDEXED IN: Scopus WOS CrossRef: 15
IN MY: ORCID
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