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DerechosPreviewFecha Public.TítuloAutor(es)Tipo
openAccess2006_Immunization.pdf.jpg2006Immunization of real complex communication networksGómez-Gardeñes, Jesús; Echenique, Pablo CSIC ORCID; Moreno, Yamirpreprint
openAccess2004_Routing.pdf.jpg15-nov-2004Improved routing strategies for Internet traffic deliveryEchenique, Pablo CSIC ORCID; Gómez-Gardeñes, Jesús; Moreno, Yamirpreprint
openAccess2007_IntroProtFoldPhys.pdf.jpgabr-2007Introduction to protein folding for physicistsEchenique, Pablo CSIC ORCIDpreprint
openAccess2012_BandedMatricesInversion.pdf.jpg19-ene-2012Linearly scaling direct method for accurately inverting sparse banded matricesGarcía-Risueño, Pablo CSIC; Echenique, Pablo CSIC ORCIDpreprint
openAccessModified Ehrenfest.pdf.jpg2009Modified Ehrenfest formalism for efficient large-scale ab initio molecular dynamicsAndrade, Xavier; Castro, Alberto; Zueco, David CSIC ORCID; Alonso, J. A. CSIC ORCID; Echenique, Pablo CSIC ORCID; Falceto, Fernando; Rubio, Angel CSIC ORCIDartículo
openAccessNon-adiabatic effects within.pdf.jpg31-ago-2012Non-adiabatic effects within a single thermally averaged potential energy surface: Thermal expansion and reaction rates of small moleculesAlonso, José Luis CSIC ORCID; Castro, Alberto; Clemente-Gallardo, Jesús; Echenique, Pablo CSIC ORCID; Mazo, J. J. CSIC ORCID; Polo, Víctor CSIC ORCID; Rubio, Angel CSIC ORCID; Zueco, David CSIC ORCIDartículo
openAccessPhysRevE.91.022137-1.pdf.jpg2015Nonextensive thermodynamic functions in the Schrödinger-Gibbs ensembleAlonso, José Luis CSIC ORCID; Castro, Alberto; Clemente-Gallardo, Jesús; Cuchí, Juan Carlos; Echenique, Pablo CSIC ORCID; Esteve, J.G.; Falceto, F.artículo
openAccess2012_TDDFTandMD.pdf.jpg2012On the combination of TDDFT with molecular dynamics: New developmentsAlonso, José Luis CSIC ORCID; Castro, Alberto; Echenique, Pablo CSIC ORCID; Rubio, Angel CSIC ORCIDcapítulo de libro
closedAccessaccesoRestringido.pdf.jpg2015Predicting stabilizing mutations in proteins using Poisson-Boltzmann based models: Study of unfolded state ensemble models and development of a successful binary classifier based on residue interaction energiesEstrada, Jorge CSIC ORCID; Echenique, Pablo CSIC ORCID; Sancho, Javier CSIC ORCIDartículo
openAccess2006_Constraints.pdf.jpg9-ago-2006Quantum mechanical calculation of the effects of stiff and rigid constraints in the conformational equilibrium of the alanine dipeptideEchenique, Pablo CSIC ORCID; Calvo, Iván; Alonso, José Luis CSIC ORCIDpreprint
openAccessEliminatingSystematicErrors.pdf.jpg31-oct-2013Reducing the standard deviation in multiple-assay experiments where the variation matters but the absolute value does notEchenique, Pablo CSIC ORCID; Nelo Bazán, María Alejandra; Carrodeguas, José A. CSIC ORCIDpreprint
openAccess2005_Distance.pdf.jpg1-abr-2005Relevant distance between two different instances of the same potential energy in protein foldingAlonso, José Luis CSIC ORCID; Echenique, Pablo CSIC ORCIDpreprint
openAccess2011_EhrenfestStatistics.pdf.jpg7-sep-2011Statistics and Nosé formalism for Ehrenfest dynamicsAlonso, José Luis CSIC ORCID; Castro, Alberto; Clemente-Gallardo, Jesús; Cuchí, Juan Carlos; Echenique, Pablo CSIC ORCID; Falceto, Fernandopreprint
openAccess2011_EquilibriumConstrained.pdf.jpgnov-2011The canonical equilibrium of constrained molecular modelsEchenique, Pablo CSIC ORCID; Cavasotto, Claudio; García-Risueño, Pablo CSICpreprint
openAccess2011_08_Quixote_meeting.pdf.jpg26-ago-2011The Quixote Project: a pioneering work in managing Computational Chemistry research dataEchenique, Pablo CSIC ORCIDpresentación
openAccess1758-2946-3-38.pdf.jpg14-oct-2011The Quixote project: Collaborative and Open Quantum Chemistry data management in the Internet ageAdams, Sam; de Castro, Pablo; Echenique, Pablo CSIC ORCID; Estrada, Jorge CSIC ORCID; Hanwell, Marcus D; Murray-Rust, Peter; Sherwood, Paul; Thomas, Jens; Townsend, Joe Aartículo
openAccess2011_Quixote.pdf.jpg2011The Quixote project: Collaborative and Open Quantum Chemistry data management in the Internet ageAdams, Sam; de Castro, Pablo; Echenique, Pablo CSIC ORCID; Estrada, Jorge CSIC ORCID; Hanwell, Marcus D; Murray-Rust, Peter; Sherwood, Paul; Thomas, Jens; Toe, Townsendpreprint