Pablo Echenique
Orcid: 0000-0001-8549-3139
According to our database1,
Pablo Echenique
authored at least 9 papers
between 2006 and 2011.
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Bibliography
2011
The Quixote project: Collaborative and Open Quantum Chemistry data management in the Internet age.
J. Cheminformatics, 2011
Exact and efficient calculation of lagrange multipliers in biological polymers with constrained bond lengths and bond angles: Proteins and nucleic acids as example cases.
J. Comput. Chem., 2011
2010
CoRR, 2010
2009
PLoS Comput. Biol., 2009
2008
Efficient model chemistries for peptides. I. General framework and a study of the heterolevel approximation in RHF and MP2 with Pople split-valence basis sets.
J. Comput. Chem., 2008
2006
Quantum mechanical calculation of the effects of stiff and rigid constraints in the conformational equilibrium of the alanine dipeptide.
J. Comput. Chem., 2006
Explicit factorization of external coordinates in constrained statistical mechanics models.
J. Comput. Chem., 2006
Definition of Systematic, Approximately Separable, and Modular Internal Coordinates (SASMIC) for macromolecular simulation.
J. Comput. Chem., 2006
J. Comput. Chem., 2006