Jaime Rodrı Guez-Guerra
12PUBLICATIONS
44CO-AUTHORS
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Publications (12)
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|Dec 28, 2023
OpenMM 8: Molecular Dynamics Simulation with Machine Learning Potentials.Peter Eastman, Raimondas Galvelis, Raúl P Peláez
|May 07, 2022
TeachOpenCADD 2022: open source and FAIR Python pipelines to assist in structural bioinformatics and cheminformatics research.Dominique Sydow, Jaime Rodríguez-Guerra, Talia B Kimber
|Apr 03, 2020
Molecular Modeling for Artificial Metalloenzyme Design and Optimization.Lur Alonso-Cotchico, Jaime Rodrı Guez-Guerra, Agustí Lledós
|Oct 16, 2019
TeachOpenCADD-KNIME: A Teaching Platform for Computer-Aided Drug Design Using KNIME Workflows.Dominique Sydow, Michele Wichmann, Jaime Rodríguez-Guerra
|Jul 03, 2019
GPathFinder: Identification of Ligand-Binding Pathways by a Multi-Objective Genetic Algorithm.José-Emilio Sánchez-Aparicio, Giuseppe Sciortino, Daniel Viladrich Herrmannsdoerfer
|May 22, 2019
Discovery of processive catalysis by an exo-hydrolase with a pocket-shaped active site.Victor A Streltsov, Sukanya Luang, Alys Peisley
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Frequent Collaborators
5 joint publications
Jean-Didier Maréchal
3 joint publications
Giuseppe Sciortino
3 joint publications
José-Emilio Sánchez-Aparicio
2 joint publications
Agustí Lledós
2 joint publications
Andrea Volkamer
2 joint publications
Michele Wichmann
2 joint publications
Dominique Sydow
1 joint publications
James R Ketudat Cairns
1 joint publications
Sebastien Fort
1 joint publications
Carme Rovira
