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Disambiguation of "Barril, Xavier"

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Transferability of fragmental contributions to the octanol/water partition coefficient: An NDDO-based MST study.

, , , , and . J. Comput. Chem., 24 (1): 32-45 (2003)

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Xavier Fontaine

Xavier Domont

Xavier Lambin

Arumainathan Xavier

Xavier Leroy

 

Other publications of authors with the same name

Enzyme Enhancement Therapy through non-competitive pharmacological chaperones., , , , , , , , , and 1 other author(s). IWBBIO, page 390-395. Copicentro Editorial, (2014)MDpocket: open-source cavity detection and characterization on molecular dynamics trajectories., , , and . Bioinform., 27 (23): 3276-3285 (2011)Classical molecular interaction potentials: Improved setup procedure in molecular dynamics simulations of proteins, , , , , , and . Proteins: Structure, Function, and Bioinformatics, 45 (4): 428--437 (2001)Extension of the MST continuum solvation model to the RM1 semiempirical hamiltonian., , , and . J. Comput. Chem., 29 (4): 578-587 (2007)Extended connectivity interaction features: improving binding affinity prediction through chemical description., , , and . Bioinform., 37 (10): 1376-1382 (2021)Transferability of fragmental contributions to the octanol/water partition coefficient: An NDDO-based MST study., , , , and . J. Comput. Chem., 24 (1): 32-45 (2003)Docking-undocking combination applied to the D3R Grand Challenge 2015., and . J. Comput. Aided Mol. Des., 30 (9): 805-815 (2016)Molecular simulation methods in drug discovery: a prospective outlook., and . J. Comput. Aided Mol. Des., 26 (1): 81-86 (2012)Cosolvent-Based Protein Pharmacophore for Ligand Enrichment in Virtual Screening., , , , , , , and . J. Chem. Inf. Model., 59 (8): 3572-3583 (2019)rDock: A Fast, Versatile and Open Source Program for Docking Ligands to Proteins and Nucleic Acids., , , , , , , , and . PLoS Comput. Biol., (2014)