Francesc Sabanés Zariquiey
5PUBLICATIONS
11CO-AUTHORS
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Publications (5)
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|Apr 08, 2025
QuantumBind-RBFE: Accurate Relative Binding Free Energy Calculations Using Neural Network Potentials.Francesc Sabanés Zariquiey, Stephen E Farr, Stefan Doerr
|Feb 20, 2024
Enhancing Protein-Ligand Binding Affinity Predictions Using Neural Network Potentials.Francesc Sabanés Zariquiey, Raimondas Galvelis, Emilio Gallicchio
|Apr 12, 2023
Validation of the Alchemical Transfer Method for the Estimation of Relative Binding Affinities of Molecular Series.Francesc Sabanés Zariquiey, Adrià Pérez, Maciej Majewski
|Jan 18, 2022
Divide and Conquer. Pocket-Opening Mixed-Solvent Simulations in the Perspective of Docking Virtual Screening Applications for Drug Discovery.Francesc Sabanés Zariquiey, Edgar Jacoby, Ann Vos
|Nov 03, 2021
Cosolvent and Dynamic Effects in Binding Pocket Search by Docking Simulations.P Bernát Szabó, Francesc Sabanés Zariquiey, Juan J Nogueira
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Frequent Collaborators
3 joint publications
Gianni De Fabritiis
2 joint publications
Emilio Gallicchio
1 joint publications
P Bernát Szabó
1 joint publications
Juan J Nogueira
1 joint publications
Herman W T van Vlijmen
1 joint publications
Gary Tresadern
1 joint publications
Jeremy Harvey
1 joint publications
Maciej Majewski
1 joint publications
Raimondas Galvelis
1 joint publications
John D Chodera
