Articoli con mandati relativi all'accesso pubblico - Pablo Echenique-RobbaUlteriori informazioni
Disponibili pubblicamente: 13
The Quixote project: Collaborative and Open Quantum Chemistry data management in the Internet age
S Adams, P de Castro, P Echenique, J Estrada, MD Hanwell, ...
Journal of cheminformatics 3, 1-27, 2011
Mandati: Government of Spain
Statistics and Nosé formalism for Ehrenfest dynamics
JL Alonso, A Castro, J Clemente-Gallardo, JC Cuchí, P Echenique, ...
Journal of Physics A: Mathematical and Theoretical 44 (39), 395004, 2011
Mandati: Government of Spain
Comment on “Correlated electron-nuclear dynamics: Exact factorization of the molecular wavefunction”[J. Chem. Phys. 137, 22A530 (2012)]
JL Alonso, J Clemente-Gallardo, P Echenique-Robba, JA Jover-Galtier
The Journal of Chemical Physics 139 (8), 2013
Mandati: Government of Spain
The canonical equilibrium of constrained molecular models
P Echenique, CN Cavasotto, P García-Risueño
The European Physical Journal Special Topics 200 (1), 5-54, 2011
Mandati: Government of Spain
Exact and efficient calculation of Lagrange multipliers in biological polymers with constrained bond lengths and bond angles: Proteins and nucleic acids as example cases
P García‐Risueño, P Echenique, JL Alonso
Journal of computational chemistry 32 (14), 3039-3046, 2011
Mandati: Government of Spain
Early growth response 1 (EGR-1) is a transcriptional regulator of mitochondrial carrier homolog 1 (MTCH 1)/presenilin 1-associated protein (PSAP)
MA Nelo-Bazán, P Latorre, A Bolado-Carrancio, FM Pérez-Campo, ...
Gene 578 (1), 52-62, 2016
Mandati: Government of Spain
Non-adiabatic effects within a single thermally averaged potential energy surface: Thermal expansion and reaction rates of small molecules
JL Alonso, A Castro, J Clemente-Gallardo, P Echenique, JJ Mazo, V Polo, ...
The Journal of Chemical Physics 137 (22), 2012
Mandati: Government of Spain
Nonextensive thermodynamic functions in the Schrödinger-Gibbs ensemble
JL Alonso, A Castro, J Clemente-Gallardo, JC Cuchí, P Echenique, ...
Physical Review E 91 (2), 022137, 2015
Mandati: Government of Spain
Linearly scaling direct method for accurately inverting sparse banded matrices
P García-Risueño, P Echenique
Journal of Physics A: Mathematical and Theoretical 45 (6), 065204, 2012
Mandati: Government of Spain
Reducing the standard deviation in multiple-assay experiments where the variation matters but the absolute value does not
P Echenique-Robba, MA Nelo-Bazán, JA Carrodeguas
PloS one 8 (10), e78205, 2013
Mandati: Government of Spain
Predicting stabilizing mutations in proteins using Poisson–Boltzmann based models: study of unfolded state ensemble models and development of a successful binary classifier …
J Estrada, P Echenique, J Sancho
Physical Chemistry Chemical Physics 17 (46), 31044-31054, 2015
Mandati: Government of Spain
A recent quantum canonical ensemble based on a suggestion by Schrödinger produces non-extensive thermodynamic functions
JL Alonso, A Castro, J Clemente-Gallardo, JC Cuchí, P Echenique-Robba, ...
arXiv preprint arXiv:1403.5960, 2014
Mandati: Government of Spain
Reducing the standard deviation in multiple-assay experiments where the variation matters but the absolute value does not
P Echenique, MA Nelo Bazán, JA Carrodeguas
Public Library of Science, 2013
Mandati: Government of Spain
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