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Current Opinion in Structural Biology
|
June 24, 2024
Quantum mechanical-based strategies in drug discovery: Finding the pace to new challenges in drug design
Tiziana Ginex, Javier Vázquez, Carolina Estarellas, et al.
The Journal of Organic Chemistry
|
October 2, 2002
Theoretical study of alkyl-pi and aryl-pi interactions. Reconciling theory and experiment
Jordi Ribas, Elena Cubero, F Javier Luque, et al.
Physical Chemistry Chemical Physics : PCCP
|
November 30, 2013
The DNA-forming properties of 6-selenoguanine
Ignacio Faustino, Carles Curutchet, F Javier Luque, et al.
The Journal of Physical Chemistry Letters
|
February 12, 2019
Development of a Structure-Based, pH-Dependent Lipophilicity Scale of Amino Acids from Continuum Solvation Calculations
William J Zamora, Josep M Campanera, F Javier Luque
Journal of the American Chemical Society
|
October 11, 2011
Shielded hydrogen bonds as structural determinants of binding kinetics: application in drug design
Peter Schmidtke, F Javier Luque, James B Murray, et al.
Journal of Computational Chemistry
|
August 20, 2003
Continuum and discrete calculation of fractional contributions to solvation free energy
Antonio Morreale, Josep Lluis Gelpí, F Javier Luque, et al.
Journal of the American Chemical Society
|
June 26, 2003
The structure and dynamics of DNA in the gas phase
Manuel Rueda, Susana G Kalko, F Javier Luque, et al.
Bioinformatics (Oxford, England)
|
October 5, 2011
MDpocket: open-source cavity detection and characterization on molecular dynamics trajectories
Peter Schmidtke, Axel Bidon-Chanal, F Javier Luque, et al.
Journal of Computer-Aided Molecular Design
|
February 27, 2003
Fast estimation of hydrogen-bonding donor and acceptor propensities: a GMIPp study
Albert Salichs, M López, V Segarra, et al.
Journal of Molecular Biology
|
October 7, 2004
Relative flexibility of DNA and RNA: a molecular dynamics study
Agnes Noy, Alberto Pérez, Filip Lankas, et al.
Page
of 22
Search research articles
Search
Showing results (31-40 of 215) with videos related to
Sort By:
Page
of 22
Current Opinion in Structural Biology
|
June 24, 2024
Quantum mechanical-based strategies in drug discovery: Finding the pace to new challenges in drug design
Tiziana Ginex, Javier Vázquez, Carolina Estarellas, et al.
The Journal of Organic Chemistry
|
October 2, 2002
Theoretical study of alkyl-pi and aryl-pi interactions. Reconciling theory and experiment
Jordi Ribas, Elena Cubero, F Javier Luque, et al.
Physical Chemistry Chemical Physics : PCCP
|
November 30, 2013
The DNA-forming properties of 6-selenoguanine
Ignacio Faustino, Carles Curutchet, F Javier Luque, et al.
The Journal of Physical Chemistry Letters
|
February 12, 2019
Development of a Structure-Based, pH-Dependent Lipophilicity Scale of Amino Acids from Continuum Solvation Calculations
William J Zamora, Josep M Campanera, F Javier Luque
Journal of the American Chemical Society
|
October 11, 2011
Shielded hydrogen bonds as structural determinants of binding kinetics: application in drug design
Peter Schmidtke, F Javier Luque, James B Murray, et al.
Journal of Computational Chemistry
|
August 20, 2003
Continuum and discrete calculation of fractional contributions to solvation free energy
Antonio Morreale, Josep Lluis Gelpí, F Javier Luque, et al.
Journal of the American Chemical Society
|
June 26, 2003
The structure and dynamics of DNA in the gas phase
Manuel Rueda, Susana G Kalko, F Javier Luque, et al.
Bioinformatics (Oxford, England)
|
October 5, 2011
MDpocket: open-source cavity detection and characterization on molecular dynamics trajectories
Peter Schmidtke, Axel Bidon-Chanal, F Javier Luque, et al.
Journal of Computer-Aided Molecular Design
|
February 27, 2003
Fast estimation of hydrogen-bonding donor and acceptor propensities: a GMIPp study
Albert Salichs, M López, V Segarra, et al.
Journal of Molecular Biology
|
October 7, 2004
Relative flexibility of DNA and RNA: a molecular dynamics study
Agnes Noy, Alberto Pérez, Filip Lankas, et al.
Page
of 22