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Maxim V Fedorov

Showing results (31-40 of 56) with videos related to

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RSC Advances|May 6, 2022
Chemical space exploration guided by deep neural networksDmitry S Karlov, Sergey Sosnin, Igor V Tetko, et al.
The Journal of Chemical Physics|April 26, 2005
Structure and stability of chiral beta-tapes: a computational coarse-grained approachGiovanni Bellesia, Maxim V Fedorov, Yuri A Kuznetsov, et al.
The Journal of Chemical Physics|August 7, 2010
Accurate calculations of the hydration free energies of druglike molecules using the reference interaction site modelDavid S Palmer, Volodymyr P Sergiievskyi, Frank Jensen, et al.
The Journal of Chemical Physics|November 24, 2016
Salting-out effects by pressure-corrected 3D-RISMMaksim Misin, Petteri A Vainikka, Maxim V Fedorov, et al.
The Journal of Physical Chemistry. B|September 17, 2010
Selective Na(+)/K(+) effects on the formation of α-cyclodextrin complexes with aromatic carboxylic acids: competition for the guestIrina V Terekhova, Anastasia O Romanova, Roman S Kumeev, 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 correctionDavid 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 databasesDavid S Palmer, Andrey I Frolov, Ekaterina L Ratkova, et al.
Journal of Computational Chemistry|May 3, 2008
Hydration of ionic species studied by the reference interaction site model with a repulsive bridge correctionGennady N Chuev, Maxim V Fedorov, Sandro Chiodo, et al.
Current Pharmaceutical Design|May 31, 2011
In silico screening of bioactive and biomimetic solutes using Integral Equation TheoryDavid S Palmer, Gennady N Chuev, Ekaterina L Ratkova, et al.
The Journal of Physical Chemistry. B|September 1, 2010
An accurate prediction of hydration free energies by combination of molecular integral equations theory with structural descriptorsEkaterina L Ratkova, Gennady N Chuev, Volodymyr P Sergiievskyi, et al.
Pageof 6

Showing results (31-40 of 56) with videos related to

Sort By:
Pageof 6
RSC Advances|May 6, 2022
Chemical space exploration guided by deep neural networksDmitry S Karlov, Sergey Sosnin, Igor V Tetko, et al.
The Journal of Chemical Physics|April 26, 2005
Structure and stability of chiral beta-tapes: a computational coarse-grained approachGiovanni Bellesia, Maxim V Fedorov, Yuri A Kuznetsov, et al.
The Journal of Chemical Physics|August 7, 2010
Accurate calculations of the hydration free energies of druglike molecules using the reference interaction site modelDavid S Palmer, Volodymyr P Sergiievskyi, Frank Jensen, et al.
The Journal of Chemical Physics|November 24, 2016
Salting-out effects by pressure-corrected 3D-RISMMaksim Misin, Petteri A Vainikka, Maxim V Fedorov, et al.
The Journal of Physical Chemistry. B|September 17, 2010
Selective Na(+)/K(+) effects on the formation of α-cyclodextrin complexes with aromatic carboxylic acids: competition for the guestIrina V Terekhova, Anastasia O Romanova, Roman S Kumeev, 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 correctionDavid 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 databasesDavid S Palmer, Andrey I Frolov, Ekaterina L Ratkova, et al.
Journal of Computational Chemistry|May 3, 2008
Hydration of ionic species studied by the reference interaction site model with a repulsive bridge correctionGennady N Chuev, Maxim V Fedorov, Sandro Chiodo, et al.
Current Pharmaceutical Design|May 31, 2011
In silico screening of bioactive and biomimetic solutes using Integral Equation TheoryDavid S Palmer, Gennady N Chuev, Ekaterina L Ratkova, et al.
The Journal of Physical Chemistry. B|September 1, 2010
An accurate prediction of hydration free energies by combination of molecular integral equations theory with structural descriptorsEkaterina L Ratkova, Gennady N Chuev, Volodymyr P Sergiievskyi, et al.
Pageof 6