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Disambiguation of "Orozco, Modesto"

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Comparison of 6-31G*-based MST/SCRF and FEP evaluations of the free energies of hydration for small neutral molecules.

, , and . J. Comput. Chem., 14 (12): 1498-1503 (1993)

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Gerardo Orozco

Modesto Gonzalez

Modesto Ponce

Johannes Modesto

Christine Modesto

 

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Ab initio study of bond stretching: Implications in force-field parametrization for molecular mechanics and dynamics., and . J. Comput. Chem., 14 (8): 881-894 (1993)Comparison of 6-31G*-based MST/SCRF and FEP evaluations of the free energies of hydration for small neutral molecules., , and . J. Comput. Chem., 14 (12): 1498-1503 (1993)Transferability of fragmental contributions to the octanol/water partition coefficient: An NDDO-based MST study., , , , and . J. Comput. Chem., 24 (1): 32-45 (2003)BIGNASim: a NoSQL database structure and analysis portal for nucleic acids simulation data., , , , , , , , , and 1 other author(s). Nucleic Acids Res., 44 (Database-Issue): 272-278 (2016)The (In)dependence of Alternative Splicing and Gene Duplication., , , , and . PLoS Comput. Biol., (2007)Defining the Nature of Thermal Intermediate in 3 State Folding Proteins: Apoflavodoxin, a Study Case., , , , and . PLoS Comput. Biol., (2012)Ligand-induced changes in the binding sites of proteins., , , , , and . Bioinform., 18 (7): 939-948 (2002)Comparison of Active Centers of Proteins: The Kinesin Family as a Test Case., , , , , , , and . Spanish Bioinformatics Conference, page 205. Technical University of Catalonia, Barcelona, (2004)BioExcel Building Blocks REST API (BioBB REST API), programmatic access to interoperable biomolecular simulation tools., , , , and . Bioinform., 38 (12): 3302-3303 (2022)Dispersion and repulsion contributions to the solvation free energy: Comparison of quantum mechanical and classical approaches in the polarizable continuum model., , , , and . J. Comput. Chem., 27 (15): 1769-1780 (2006)