Nuno Manuel Ferreira de Sousa de Azevedo Cerqueira


AuthID: R-000-NH4

Confirmed Publications: 93



11
TITLE: (3S,4R)-3,4-Dihydroxy-N-alkyl-l-homoprolines: synthesis and computational mechanistic studies  Full Text
AUTHORS: Freitas, DS; Sousa, CEA; Parente, J; Drogalin, A; Fortes, AG; Cerqueira, NMFSA ; Alves, MJ;
PUBLISHED: 2019, SOURCE: ORGANIC & BIOMOLECULAR CHEMISTRY, VOLUME: 17, ISSUE: 47
INDEXED IN: Scopus WOS CrossRef: 1
IN MY: ORCID
12
TITLE: Evaluation of Scoring Functions for Large Scale Application of Virtual Screening in the Identification of Novel Beta-Lactamase Inhibitors
AUTHORS: Vieira, TF; Magalhaes, RP; Cerqueira, NMFSA ; Sérgio F. Sousa ;
PUBLISHED: 2019, SOURCE: 6th IEEE Portuguese Meeting on Bioengineering (ENBENG) in 2019 6TH IEEE PORTUGUESE MEETING IN BIOENGINEERING (ENBENG)
INDEXED IN: Scopus WOS CrossRef
13
14
TITLE: Molecular dynamic simulations and QM/MM studies addressed to build an active Tryptophan Synthase model. A critical enzyme to treat tuberculosis
AUTHORS: Teixeira, CSS; Sérgio F. Sousa ; Cerqueira, NMFSA ;
PUBLISHED: 2019, SOURCE: 6th IEEE Portuguese Meeting on Bioengineering (ENBENG) in 2019 6TH IEEE PORTUGUESE MEETING IN BIOENGINEERING (ENBENG)
INDEXED IN: Scopus WOS CrossRef
15
TITLE: New insights about the monomer and homodimer structures of the human AOX1  Full Text
AUTHORS: Ferreira, P; Cerqueira, NMFSA ; Coelho, C; Fernandes, PA ; Romao, MJ; Ramos, MJ ;
PUBLISHED: 2019, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 21, ISSUE: 25
INDEXED IN: Scopus WOS CrossRef: 6
IN MY: ORCID
16
TITLE: PLP-dependent enzymes as important biocatalysts for the pharmaceutical, chemical and food industries: a structural and mechanistic perspective
AUTHORS: Rocha, JF; Pina, AF; Sérgio F. Sousa ; Cerqueira, NMFSA ;
PUBLISHED: 2019, SOURCE: CATALYSIS SCIENCE & TECHNOLOGY, VOLUME: 9, ISSUE: 18
INDEXED IN: Scopus WOS CrossRef: 61
IN MY: ORCID
17
TITLE: VMD Store-A VMD Plugin to Browse, Discover, and Install VMD Extensions  Full Text
AUTHORS: Fernandes, HS ; Sérgio F. Sousa ; Cerqueira, NMFSA ;
PUBLISHED: 2019, SOURCE: JOURNAL OF CHEMICAL INFORMATION AND MODELING, VOLUME: 59, ISSUE: 11
INDEXED IN: Scopus WOS CrossRef: 43
18
TITLE: Catalytic Mechanism of the Serine Hydroxymethyltransferase: A Computational ONIOM QM/MM Study
AUTHORS: Henrique S Fernandes ; Maria Joao Ramos ; Nuno M F S A Cerqueira ;
PUBLISHED: 2018, SOURCE: ACS CATALYSIS, VOLUME: 8, ISSUE: 11
INDEXED IN: Scopus WOS CrossRef: 31
19
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
20
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: 8
Page 2 of 10. Total results: 93.

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