Showing results (81-90 of 179) with videos related to
Sort By:
Pageof 18
Journal of the American Chemical Society|May 2, 2002
Theoretical evaluation of pK(a) in phosphoranes: implications for phosphate ester hydrolysisXabier Lopez, Michael Schaefer, Annick Dejaegere, et al.Proteins|September 25, 2023
Atomistic molecular simulations of Aβ-Zn conformational ensemblesJulen Aduriz-Arrizabalaga, Xabier Lopez, David De SanchoJournal of the American Chemical Society|June 12, 2003
Hybrid QM/MM study of thio effects in transphosphorylation reactionsBrent A Gregersen, Xabier Lopez, Darrin M YorkOrganic & Biomolecular Chemistry|December 20, 2011
Mechanism of C-terminal intein cleavage in protein splicing from QM/MM molecular dynamics simulationsJon I Mujika, Xabier Lopez, Adrian J MulhollandPhysical Chemistry Chemical Physics : PCCP|August 8, 2023
Influence of metal binding on the conformational landscape of neurofilament peptidesDavid Silva-Brea, David de Sancho, Xabier LopezJournal of Chemical Theory and Computation|March 6, 2026
5- and 6-Membered Rings: A Natural Orbital Functional StudyIon Mitxelena, Juan Felipe Huan Lew-Yee, Mario PirisThe Journal of Chemical Physics|December 22, 2014
Two new constraints for the cumulant matrixEloy Ramos-Cordoba, Pedro Salvador, Mario Piris, et al.Journal of Chemical Theory and Computation|November 22, 2021
Coupling Natural Orbital Functional Theory and Many-Body Perturbation Theory by Using Nondynamically Correlated Canonical OrbitalsMauricio Rodríguez-Mayorga, Ion Mitxelena, Fabien Bruneval, et al.Physical Chemistry Chemical Physics : PCCP|March 29, 2017
The aromaticity of dicupra[10]annulenesRafael Grande-Aztatzi, Jose M Mercero, Eduard Matito, et al.Macromolecular Rapid Communications|June 4, 2011
Synthesis of cationic polyelectrolytes by inverse microemulsion polymerizationGemma González, Jesus M Ugalde, José C de la Cal, et al.Pageof 18