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Gilles Pieffet
Gilles Pieffet
Dirección de correo verificada de uan.edu.co
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Binding ensemble profiling with photoaffinity labeling (BEProFL) approach: mapping the binding poses of HDAC8 inhibitors
B He, S Velaparthi, G Pieffet, C Pennington, A Mahesh, DL Holzle, ...
Journal of medicinal chemistry 52 (22), 7003-7013, 2009
562009
Sampling and convergence in free energy calculations of protein-ligand interactions: The binding of triphenoxypyridine derivatives to factor Xa and trypsin
A Villa, R Zangi, G Pieffet, AE Mark
Journal of computer-aided molecular design 17 (10), 673-686, 2003
322003
Parameterization of aromatic azido groups: application as photoaffinity probes in molecular dynamics studies
G Pieffet, PA Petukhov
Journal of molecular modeling 15 (11), 1291-1297, 2009
122009
Exploring the local elastic properties of bilayer membranes using molecular dynamics simulations
G Pieffet, A Botero, GH Peters, M Forero-Shelton, C Leidy
The Journal of Physical Chemistry B 118 (45), 12883-12891, 2014
72014
Functional heterologous expression of mature lipase LipA from Pseudomonas aeruginosa PSA01 in Escherichia coli SHuffle and BL21 (DE3): effect of the expression host on thermal …
IY Pulido, E Prieto, GP Pieffet, L Méndez, CA Jiménez-Junca
International Journal of Molecular Sciences 21 (11), 3925, 2020
62020
Theoretical kinetic study of the reaction of SF5 radical with F2, Cl2 and SF5
C Buendía-Atencio, GP Pieffet, AE Croce, CJ Cobos
Computational and Theoretical Chemistry 1090, 41-46, 2016
62016
The application of molecular dynamics simulation techniques and free energy calculations to predict protein-protein and protein-ligand interactions
GP Pieffet
University Library Groningen][Host], 2005
42005
The application of molecular dynamics simulation techniques and free energy
G Pieffet
Groningen: sn 126, 2005
22005
Composite Methods and DFT Investigations of the Structures, Vibrational Frequencies and Energies of SF5OOX (X=H, F and Cl) and their Anions
V Lorett‐Velásquez, JA Martínez‐Bernal, GP Pieffet, C Buendía‐Atencio
ChemistrySelect 4 (48), 14291-14299, 2019
12019
High level ab initio thermochemistry of SF5OOO radical
JAM Bernal, G Pieffet, VPL Velásquez, C Buendía-Atencio
Computational and Theoretical Chemistry 1148, 8-15, 2019
12019
WERNER: A Card Game for Reinforcement Learning of Inorganic Chemistry Nomenclature
C Buendía-Atencio, GP Pieffet, VP Lorett Velásquez
Journal of Chemical Education, 2022
2022
WERNER: A Card Game for Reinforcement Learning of Inorganic Chemistry Nomenclature
CB Atencio, GP Pieffet, VPL Velásquez
Journal of chemical education 99 (5), 2198-2203, 2022
2022
Inverse Molecular Docking Study of NS3-Helicase and NS5-RNA Polymerase of Zika Virus as Possible Therapeutic Targets of Ligands Derived from Marcetia taxifolia and Its …
C Buendia-Atencio, GP Pieffet, S Montoya-Vargas, JA Martínez Bernal, ...
ACS omega 6 (9), 6134-6143, 2021
2021
Inteligencia artificial: pasado, presente y futuro
GP Pieffet
Revista SayWa 2 (3), 2020
2020
Ab initio computational thermochemistry of SF5OOX (X= H, F an Cl)
J Martinez, G Pieffet, V Lorett, C Buendia
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 257, 2019
2019
CARACTERIZACIÓN COMPUTACIONAL DE COMPUESTOS QUÍMICOS LIBERADORES DE MONÓXIDO DE CARBONO DE INTERÉS EN LA INDUSTRIA FARMACÉUTICA.
C Buendía, V Lorett, G Pieffet
Encuentro Facultad de Ciencias-UPTC Décima Versión-II Encuentro Nacional …, 2017
2017
Theoretical kinetic study of the reaction of SF₅ radical with F₂, Cl₂ and SF₅
C Buendía-Atencio, G Pieffet, AE Croce, CJ Cobos
Computational and Theoretical Chemistry 1090, 2016
2016
Lysolipid Concentration Effect on the Properties of a Membrane using Molecular Dynamics
JD Orjuela, C Leidy, GH Peters, GP Pieffet
Biophysical Journal 106 (2), 704a, 2014
2014
Insights onto the Extraction of a Lipid from a Membrane using Molecular Dynamics Simulations
GP Pieffet, M Forero, GH Peters, C Leidy
Biophysical Journal 102 (3), 290a-291a, 2012
2012
Binary QSAR model for classification of calpain inhibitors
EL Mendonca, G Pieffet, I Schiefer, V Sinha, CE Ranepuradewage, ...
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 237, 2009
2009
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Artículos 1–20