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The Journal of Physical Chemistry. B|March 24, 2006
Structure of isolated tryptophyl-glycine dipeptide and tryptophyl-glycyl-glycine tripeptide: ab initio SCC-DFTB-D molecular dynamics simulations and high-level correlated ab initio quantum chemical calculationsHaydee Valdés, David Reha, Pavel HobzaJournal of the American Chemical Society|October 7, 2008
From the X-ray compact structure to the elongated form of the full-length MMP-2 enzyme in solution: a molecular dynamics studyNatalia Díaz, Dimas Suárez, Haydee ValdésJournal of Chemical Theory and Computation|December 2, 2015
Monoligand Zn(II) Complexes: Ab Initio Benchmark Calculations and Comparison with Density Functional Theory MethodologiesVíctor M Rayón, Haydee Valdés, Natalia Díaz, et al.Journal of Chemical Theory and Computation|December 1, 2015
Interdomain Conformations in the Full-Length MMP-2 Enzyme Explored by Protein-Protein Docking Calculations Using pyDockHaydee Valdés, Natalia Díaz, Dimas Suárez, et al.The Journal of Physical Chemistry. A|June 22, 2007
Cyanides and isocyanides of first-row transition metals: molecular structure, bonding, and isomerization barriersVíctor M Rayón, Pilar Redondo, Haydee Valdés, et al.The Journal of Physical Chemistry. A|January 24, 2009
Polyisocyanides of titaniumVíctor M Rayón, Pilar Redondo, Haydee Valdés, et al.Chemistry (Weinheim an Der Bergstrasse, Germany)|August 31, 2010
Ketone-alcohol hydrogen-transfer equilibria: is the biooxidation of halohydrins blocked?Fabricio R Bisogno, Eduardo García-Urdiales, Haydee Valdés, et al.Organic Letters|May 2, 2015
Chemoselective intramolecular functionalization of methyl groups in nonconstrained molecules promoted by N-iodosulfonamidesNieves R Paz, Dionisio Rodríguez-Sosa, Haydee Valdés, et al.Pageof 1