Francesc Sabanés Zariquiey

According to our database, Francesc Sabanés Zariquiey authored at least 6 papers between 2021 and 2026.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of five.

2026

AceFF: A State-of-the-Art Machine Learning Potential for Small Molecules.

Stephen E. Farr, Stefan Doerr, Antonio Mirarchi, Francesc Sabanés Zariquiey, Gianni De Fabritiis

CoRR, January, 2026

2025

QuantumBind-RBFE: Accurate Relative Binding Free Energy Calculations Using Neural Network Potentials.

Francesc Sabanés Zariquiey, Stephen E. Farr, Stefan Doerr, Gianni De Fabritiis

J. Chem. Inf. Model., 2025

2024

Enhancing Protein-Ligand Binding Affinity Predictions Using Neural Network Potentials.

Francesc Sabanés Zariquiey, Raimondas Galvelis, Emilio Gallicchio, John D. Chodera, Thomas E. Markland, Gianni De Fabritiis

J. Chem. Inf. Model., March, 2024

2023

Validation of the Alchemical Transfer Method for the Estimation of Relative Binding Affinities of Molecular Series.

Francesc Sabanés Zariquiey, Adrià Pérez, Maciej Majewski, Emilio Gallicchio, Gianni De Fabritiis

J. Chem. Inf. Model., April, 2023

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, Herman W. T. van Vlijmen, Gary Tresadern, Jeremy N. Harvey

J. Chem. Inf. Model., 2022

2021

Cosolvent and Dynamic Effects in Binding Pocket Search by Docking Simulations.

P. Bernát Szabó, Francesc Sabanés Zariquiey, Juan J. Nogueira

J. Chem. Inf. Model., 2021