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Journal of Chemical Theory and Computation
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November 19, 2015
In Silico Design of Monomolecular Drug Carriers for the Tyrosine Kinase Inhibitor Drug Imatinib Based on Calix- and Thiacalix[n]arene Host Molecules: A DFT and Molecular Dynamics Study
Rodrigo Galindo-Murillo, María Eugenia Sandoval-Salinas, Joaquín Barroso-Flores
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
May 3, 2017
The Role of the DNA Backbone in Minor-Groove Ligand Binding
Dalia G Díaz-Gómez, Rodrigo Galindo-Murillo, Fernando Cortés-Guzmán
Journal of Computational Chemistry
|
December 31, 2015
A mixed DFT-MD methodology for the in silico development of drug releasing macrocycles. Calix and thia-calix[N]arenes as carriers for Bosutinib and Sorafenib
Rodrigo Galindo-Murillo, Luis Enrique Aguilar-Suárez, Joaquín Barroso-Flores
Physical Chemistry Chemical Physics : PCCP
|
October 18, 2012
Molecular recognition between DNA and a copper-based anticancer complex
Rodrigo Galindo-Murillo, Lena Ruíz-Azuara, Rafael Moreno-Esparza, et al.
Journal of Chemical Information and Modeling
|
June 11, 2016
Using Wavelet Analysis To Assist in Identification of Significant Events in Molecular Dynamics Simulations
Zahra Heidari, Daniel R Roe, Rodrigo Galindo-Murillo, et al.
Journal of Chemical Theory and Computation
|
November 21, 2015
Refinement of the Sugar-Phosphate Backbone Torsion Beta for AMBER Force Fields Improves the Description of Z- and B-DNA
Marie Zgarbová, Jiří Šponer, Michal Otyepka, et al.
Journal of Chemical Theory and Computation
|
June 21, 2023
Assessing the Current State of Amber Force Field Modifications for DNA─2023 Edition
Olivia Love, Rodrigo Galindo-Murillo, Marie Zgarbová, et al.
The Journal of Physical Chemistry. B
|
December 17, 2016
Computational Assessment of Potassium and Magnesium Ion Binding to a Buried Pocket in GTPase-Associating Center RNA
Hamed S Hayatshahi, Daniel R Roe, Rodrigo Galindo-Murillo, et al.
Nucleic Acids Research
|
May 11, 2015
Intercalation processes of copper complexes in DNA
Rodrigo Galindo-Murillo, Juan Carlos García-Ramos, Lena Ruiz-Azuara, et al.
Journal of Chemical Theory and Computation
|
June 15, 2016
Assessing the Current State of Amber Force Field Modifications for DNA
Rodrigo Galindo-Murillo, James C Robertson, Marie Zgarbová, et al.
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Search research articles
Search
Showing results (21-30 of 64) with videos related to
Sort By:
Page
of 7
Journal of Chemical Theory and Computation
|
November 19, 2015
In Silico Design of Monomolecular Drug Carriers for the Tyrosine Kinase Inhibitor Drug Imatinib Based on Calix- and Thiacalix[n]arene Host Molecules: A DFT and Molecular Dynamics Study
Rodrigo Galindo-Murillo, María Eugenia Sandoval-Salinas, Joaquín Barroso-Flores
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
May 3, 2017
The Role of the DNA Backbone in Minor-Groove Ligand Binding
Dalia G Díaz-Gómez, Rodrigo Galindo-Murillo, Fernando Cortés-Guzmán
Journal of Computational Chemistry
|
December 31, 2015
A mixed DFT-MD methodology for the in silico development of drug releasing macrocycles. Calix and thia-calix[N]arenes as carriers for Bosutinib and Sorafenib
Rodrigo Galindo-Murillo, Luis Enrique Aguilar-Suárez, Joaquín Barroso-Flores
Physical Chemistry Chemical Physics : PCCP
|
October 18, 2012
Molecular recognition between DNA and a copper-based anticancer complex
Rodrigo Galindo-Murillo, Lena Ruíz-Azuara, Rafael Moreno-Esparza, et al.
Journal of Chemical Information and Modeling
|
June 11, 2016
Using Wavelet Analysis To Assist in Identification of Significant Events in Molecular Dynamics Simulations
Zahra Heidari, Daniel R Roe, Rodrigo Galindo-Murillo, et al.
Journal of Chemical Theory and Computation
|
November 21, 2015
Refinement of the Sugar-Phosphate Backbone Torsion Beta for AMBER Force Fields Improves the Description of Z- and B-DNA
Marie Zgarbová, Jiří Šponer, Michal Otyepka, et al.
Journal of Chemical Theory and Computation
|
June 21, 2023
Assessing the Current State of Amber Force Field Modifications for DNA─2023 Edition
Olivia Love, Rodrigo Galindo-Murillo, Marie Zgarbová, et al.
The Journal of Physical Chemistry. B
|
December 17, 2016
Computational Assessment of Potassium and Magnesium Ion Binding to a Buried Pocket in GTPase-Associating Center RNA
Hamed S Hayatshahi, Daniel R Roe, Rodrigo Galindo-Murillo, et al.
Nucleic Acids Research
|
May 11, 2015
Intercalation processes of copper complexes in DNA
Rodrigo Galindo-Murillo, Juan Carlos García-Ramos, Lena Ruiz-Azuara, et al.
Journal of Chemical Theory and Computation
|
June 15, 2016
Assessing the Current State of Amber Force Field Modifications for DNA
Rodrigo Galindo-Murillo, James C Robertson, Marie Zgarbová, et al.
Page
of 7