Segui
Pablo Echenique-Robba
Pablo Echenique-Robba
Staff Scientist, Instituto de Química Física Rocasolano, CSIC
Email verificata su iqfr.csic.es
Titolo
Citata da
Citata da
Anno
Improved routing strategies for Internet traffic delivery
P Echenique, J Gómez-Gardeñes, Y Moreno
Physical Review E—Statistical, Nonlinear, and Soft Matter Physics 70 (5 …, 2004
3292004
Dynamics of jamming transitions in complex networks
P Echenique, J Gómez-Gardenes, Y Moreno
Europhysics letters 71 (2), 325, 2005
3162005
A mathematical and computational review of Hartree–Fock SCF methods in quantum chemistry
P Echenique, JL Alonso
Molecular Physics 105 (23-24), 3057-3098, 2007
2332007
Modified Ehrenfest formalism for efficient large-scale ab initio molecular dynamics
X Andrade, A Castro, D Zueco, JL Alonso, P Echenique, F Falceto, ...
Journal of chemical theory and computation 5 (4), 728-742, 2009
1782009
Exploring the free energy landscape: from dynamics to networks and back
D Prada-Gracia, J Gómez-Gardeñes, P Echenique, F Falo
PLoS computational biology 5 (6), e1000415, 2009
1542009
Efficient Formalism for Large-Scale Ab Initio Molecular Dynamics <?format ?>based on Time-Dependent Density Functional Theory
JL Alonso, X Andrade, P Echenique, F Falceto, D Prada-Gracia, A Rubio
Physical review letters 101 (9), 096403, 2008
1372008
Immunization of real complex communication networks
J Gómez-Gardenes, P Echenique, Y Moreno
The European Physical Journal B-Condensed Matter and Complex Systems 49, 259-264, 2006
1092006
Distance- covering problems in scale-free networks with degree correlations
P Echenique, J Gómez-Gardeñes, Y Moreno, A Vázquez
Physical Review E—Statistical, Nonlinear, and Soft Matter Physics 71 (3 …, 2005
602005
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
552011
Introduction to protein folding for physicists
P Echenique
Contemporary Physics 48 (2), 81-108, 2007
502007
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
452011
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
432013
Ehrenfest dynamics is purity non-preserving: A necessary ingredient for decoherence
JL Alonso, J Clemente-Gallardo, JC Cuchí, P Echenique, F Falceto
The Journal of Chemical Physics 137 (5), 2012
342012
Quantum mechanical calculation of the effects of stiff and rigid constraints in the conformational equilibrium of the Alanine dipeptide
P Echenique, I Calvo, JL Alonso
Journal of computational chemistry 27 (14), 1733-1747, 2006
322006
J. G omez-Gardeñes and Y. Moreno
P Echenique
Phys. Rev. E 70, 056105, 2004
232004
Ab initio molecular dynamics on the electronic Boltzmann equilibrium distribution
JL Alonso, A Castro, P Echenique, V Polo, A Rubio, D Zueco
New Journal of Physics 12 (8), 083064, 2010
22*2010
Definition of systematic, approximately separable, and modular internal coordinates (SASMIC) for macromolecular simulation
P Echenique, JL Alonso
Journal of computational chemistry 27 (10), 1076-1087, 2006
202006
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
P Echenique, JL Alonso
Journal of computational chemistry 29 (9), 1408-1422, 2008
192008
A physically meaningful method for the comparison of potential energy functions
JL Alonso, P Echenique
Journal of computational chemistry 27 (2), 238-252, 2006
172006
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
152011
Il sistema al momento non può eseguire l'operazione. Riprova più tardi.
Articoli 1–20