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Methods in Molecular Biology (Clifton, N.J.)
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February 5, 2020
Binding Free Energy Calculation Using Quantum Mechanics Aimed for Drug Lead Optimization
Claudio N Cavasotto
Methods in Molecular Biology (Clifton, N.J.)
|
December 21, 2011
Normal mode-based approaches in receptor ensemble docking
Claudio N Cavasotto
Current Topics in Medicinal Chemistry
|
April 23, 2011
Homology models in docking and high-throughput docking
Claudio N Cavasotto
Archives of Biochemistry and Biophysics
|
August 15, 2015
Open challenges in structure-based virtual screening: Receptor modeling, target flexibility consideration and active site water molecules description
Francesca Spyrakis, Claudio N Cavasotto
Chemical Communications (Cambridge, England)
|
August 11, 2015
Expanding the horizons of G protein-coupled receptor structure-based ligand discovery and optimization using homology models
Claudio N Cavasotto, Damián Palomba
ACS Omega
|
January 2, 2023
Machine Learning Toxicity Prediction: Latest Advances by Toxicity End Point
Claudio N Cavasotto, Valeria Scardino
The Journal of Physical Chemistry. B
|
May 19, 2011
Hydration free energies using semiempirical quantum mechanical Hamiltonians and a continuum solvent model with multiple atomic-type parameters
Victor M Anisimov, Claudio N Cavasotto
Methods in Molecular Biology (Clifton, N.J.)
|
October 29, 2010
Docking methods for structure-based library design
Claudio N Cavasotto, Sharangdhar S Phatak
Methods in Molecular Biology (Clifton, N.J.)
|
February 5, 2020
Molecular Docking Using Quantum Mechanical-Based Methods
M Gabriela Aucar, Claudio N Cavasotto
Journal of Molecular Biology
|
March 6, 2004
Protein flexibility in ligand docking and virtual screening to protein kinases
Claudio N Cavasotto, Ruben A Abagyan
Page
of 7
Search research articles
Search
Showing results (1-10 of 68) with videos related to
Sort By:
Page
of 7
Methods in Molecular Biology (Clifton, N.J.)
|
February 5, 2020
Binding Free Energy Calculation Using Quantum Mechanics Aimed for Drug Lead Optimization
Claudio N Cavasotto
Methods in Molecular Biology (Clifton, N.J.)
|
December 21, 2011
Normal mode-based approaches in receptor ensemble docking
Claudio N Cavasotto
Current Topics in Medicinal Chemistry
|
April 23, 2011
Homology models in docking and high-throughput docking
Claudio N Cavasotto
Archives of Biochemistry and Biophysics
|
August 15, 2015
Open challenges in structure-based virtual screening: Receptor modeling, target flexibility consideration and active site water molecules description
Francesca Spyrakis, Claudio N Cavasotto
Chemical Communications (Cambridge, England)
|
August 11, 2015
Expanding the horizons of G protein-coupled receptor structure-based ligand discovery and optimization using homology models
Claudio N Cavasotto, Damián Palomba
ACS Omega
|
January 2, 2023
Machine Learning Toxicity Prediction: Latest Advances by Toxicity End Point
Claudio N Cavasotto, Valeria Scardino
The Journal of Physical Chemistry. B
|
May 19, 2011
Hydration free energies using semiempirical quantum mechanical Hamiltonians and a continuum solvent model with multiple atomic-type parameters
Victor M Anisimov, Claudio N Cavasotto
Methods in Molecular Biology (Clifton, N.J.)
|
October 29, 2010
Docking methods for structure-based library design
Claudio N Cavasotto, Sharangdhar S Phatak
Methods in Molecular Biology (Clifton, N.J.)
|
February 5, 2020
Molecular Docking Using Quantum Mechanical-Based Methods
M Gabriela Aucar, Claudio N Cavasotto
Journal of Molecular Biology
|
March 6, 2004
Protein flexibility in ligand docking and virtual screening to protein kinases
Claudio N Cavasotto, Ruben A Abagyan
Page
of 7