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Journal of Chemical Theory and Computation
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November 18, 2015
Accurate Calculation of Solvation Free Energies in Supercritical Fluids by Fully Atomistic Simulations: Probing the Theory of Solutions in Energy Representation
Andrey I Frolov
The Journal of Physical Chemistry. B
|
September 3, 2014
Prediction of cosolvent effect on solvation free energies and solubilities of organic compounds in supercritical carbon dioxide based on fully atomistic molecular simulations
Andrey I Frolov, Michael G Kiselev
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
July 15, 2010
Ion interactions with the carbon nanotube surface in aqueous solutions: understanding the molecular mechanisms
Andrey I Frolov, Alex G Rozhin, Maxim V Fedorov
Faraday Discussions
|
March 30, 2012
Molecular-scale insights into the mechanisms of ionic liquids interactions with carbon nanotubes
Andrey I Frolov, Kathleen Kirchner, Tom Kirchner, et al.
Journal of Chemical Information and Modeling
|
December 27, 2022
pIChemiSt ─ Free Tool for the Calculation of Isoelectric Points of Modified Peptides
Andrey I Frolov, Sunay V Chankeshwara, Zeyed Abdulkarim, et al.
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
March 17, 2011
Towards a universal method for calculating hydration free energies: a 3D reference interaction site model with partial molar volume correction
David S Palmer, Andrey I Frolov, Ekaterina L Ratkova, et al.
Molecular Pharmaceutics
|
May 31, 2011
Toward a universal model to calculate the solvation thermodynamics of druglike molecules: the importance of new experimental databases
David S Palmer, Andrey I Frolov, Ekaterina L Ratkova, et al.
The Journal of Physical Chemistry. B
|
April 15, 2011
Hydration thermodynamics using the reference interaction site model: speed or accuracy?
Andrey I Frolov, Ekaterina L Ratkova, David S Palmer, et al.
Journal of Medicinal Chemistry
|
July 1, 2016
Therapeutic Potential of Foldamers: From Chemical Biology Tools To Drug Candidates?
Ranganath Gopalakrishnan, Andrey I Frolov, Laurent Knerr, et al.
Journal of Chemical Information and Modeling
|
December 30, 2025
Peptide-Tools-Web Server for Calculating Physicochemical Properties of Peptides
Andrey I Frolov, Justin Morley, Ana Gomes Dos Santos, et al.
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of 2
Search research articles
Search
Showing results (1-10 of 17) with videos related to
Sort By:
Page
of 2
Journal of Chemical Theory and Computation
|
November 18, 2015
Accurate Calculation of Solvation Free Energies in Supercritical Fluids by Fully Atomistic Simulations: Probing the Theory of Solutions in Energy Representation
Andrey I Frolov
The Journal of Physical Chemistry. B
|
September 3, 2014
Prediction of cosolvent effect on solvation free energies and solubilities of organic compounds in supercritical carbon dioxide based on fully atomistic molecular simulations
Andrey I Frolov, Michael G Kiselev
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
July 15, 2010
Ion interactions with the carbon nanotube surface in aqueous solutions: understanding the molecular mechanisms
Andrey I Frolov, Alex G Rozhin, Maxim V Fedorov
Faraday Discussions
|
March 30, 2012
Molecular-scale insights into the mechanisms of ionic liquids interactions with carbon nanotubes
Andrey I Frolov, Kathleen Kirchner, Tom Kirchner, et al.
Journal of Chemical Information and Modeling
|
December 27, 2022
pIChemiSt ─ Free Tool for the Calculation of Isoelectric Points of Modified Peptides
Andrey I Frolov, Sunay V Chankeshwara, Zeyed Abdulkarim, et al.
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
March 17, 2011
Towards a universal method for calculating hydration free energies: a 3D reference interaction site model with partial molar volume correction
David S Palmer, Andrey I Frolov, Ekaterina L Ratkova, et al.
Molecular Pharmaceutics
|
May 31, 2011
Toward a universal model to calculate the solvation thermodynamics of druglike molecules: the importance of new experimental databases
David S Palmer, Andrey I Frolov, Ekaterina L Ratkova, et al.
The Journal of Physical Chemistry. B
|
April 15, 2011
Hydration thermodynamics using the reference interaction site model: speed or accuracy?
Andrey I Frolov, Ekaterina L Ratkova, David S Palmer, et al.
Journal of Medicinal Chemistry
|
July 1, 2016
Therapeutic Potential of Foldamers: From Chemical Biology Tools To Drug Candidates?
Ranganath Gopalakrishnan, Andrey I Frolov, Laurent Knerr, et al.
Journal of Chemical Information and Modeling
|
December 30, 2025
Peptide-Tools-Web Server for Calculating Physicochemical Properties of Peptides
Andrey I Frolov, Justin Morley, Ana Gomes Dos Santos, et al.
Page
of 2