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Journal of Chemical Theory and Computation
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November 20, 2015
Benchmarking of Density Functionals for the Accurate Description of Thiol-Disulfide Exchange
Rui P P Neves, Pedro A Fernandes, António J C Varandas, et al.
Molecules (Basel, Switzerland)
|
August 14, 2025
Unveiling the Power of Computational Tools in Chiral Liquid Chromatography
Rita Lima, Rui P P Neves, Pedro A Fernandes, et al.
Biological Chemistry
|
October 28, 2018
Structural and mechanistic aspects of S-S bonds in the thioredoxin-like family of proteins
Sérgio F Sousa, Rui P P Neves, Sodiq O Waheed, et al.
Journal of Chemical Information and Modeling
|
February 12, 2026
Mechanism of Polyester Hydrolysis by Marine Bacterium PE-H Enzyme: an Atomistic and Thermodynamic Characterization
Samah Nassir, Pedro Paiva, Rui P P Neves, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
June 10, 2022
Different Enzyme Conformations Induce Different Mechanistic Traits in HIV-1 Protease
João T S Coimbra, Rui P P Neves, Ana V Cunha, et al.
Journal of Chemical Information and Modeling
|
April 29, 2024
DszA Catalyzes C-S Bond Cleavage through N<sup>5</sup>-Hydroperoxyl Formation
Pedro Ferreira, Rui P P Neves, Filipa P Miranda, et al.
Physical Chemistry Chemical Physics : PCCP
|
August 2, 2018
Properties that rank protein:protein docking poses with high accuracy
Inês C M Simões, João T S Coimbra, Rui P P Neves, et al.
Chemical Reviews
|
June 22, 2021
Animal Fatty Acid Synthase: A Chemical Nanofactory
Pedro Paiva, Fabiola E Medina, Matilde Viegas, et al.
Bioorganic Chemistry
|
December 28, 2020
Combined in silico and in vitro studies to identify novel antidiabetic flavonoids targeting glycogen phosphorylase
Natércia F Brás, Rui P P Neves, Filipa A A Lopes, et al.
Journal of Advanced Research
|
May 7, 2026
Achieving stable blue coloration of anthocyanins through pH-Modulated protein complexation
Wenxin Wang, Susana Soares, João T S Coimbra, et al.
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of 3
Search research articles
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Showing results (11-20 of 22) with videos related to
Sort By:
Page
of 3
Journal of Chemical Theory and Computation
|
November 20, 2015
Benchmarking of Density Functionals for the Accurate Description of Thiol-Disulfide Exchange
Rui P P Neves, Pedro A Fernandes, António J C Varandas, et al.
Molecules (Basel, Switzerland)
|
August 14, 2025
Unveiling the Power of Computational Tools in Chiral Liquid Chromatography
Rita Lima, Rui P P Neves, Pedro A Fernandes, et al.
Biological Chemistry
|
October 28, 2018
Structural and mechanistic aspects of S-S bonds in the thioredoxin-like family of proteins
Sérgio F Sousa, Rui P P Neves, Sodiq O Waheed, et al.
Journal of Chemical Information and Modeling
|
February 12, 2026
Mechanism of Polyester Hydrolysis by Marine Bacterium PE-H Enzyme: an Atomistic and Thermodynamic Characterization
Samah Nassir, Pedro Paiva, Rui P P Neves, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
June 10, 2022
Different Enzyme Conformations Induce Different Mechanistic Traits in HIV-1 Protease
João T S Coimbra, Rui P P Neves, Ana V Cunha, et al.
Journal of Chemical Information and Modeling
|
April 29, 2024
DszA Catalyzes C-S Bond Cleavage through N<sup>5</sup>-Hydroperoxyl Formation
Pedro Ferreira, Rui P P Neves, Filipa P Miranda, et al.
Physical Chemistry Chemical Physics : PCCP
|
August 2, 2018
Properties that rank protein:protein docking poses with high accuracy
Inês C M Simões, João T S Coimbra, Rui P P Neves, et al.
Chemical Reviews
|
June 22, 2021
Animal Fatty Acid Synthase: A Chemical Nanofactory
Pedro Paiva, Fabiola E Medina, Matilde Viegas, et al.
Bioorganic Chemistry
|
December 28, 2020
Combined in silico and in vitro studies to identify novel antidiabetic flavonoids targeting glycogen phosphorylase
Natércia F Brás, Rui P P Neves, Filipa A A Lopes, et al.
Journal of Advanced Research
|
May 7, 2026
Achieving stable blue coloration of anthocyanins through pH-Modulated protein complexation
Wenxin Wang, Susana Soares, João T S Coimbra, et al.
Page
of 3