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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
Chemical Reviews
|
June 16, 2015
Solvation thermodynamics of organic molecules by the molecular integral equation theory: approaching chemical accuracy
Ekaterina L Ratkova, David S Palmer, Maxim V Fedorov
Scientific Reports
|
July 21, 2021
Transformer-based artificial neural networks for the conversion between chemical notations
Lev Krasnov, Ivan Khokhlov, Maxim V Fedorov, et al.
Physical Chemistry Chemical Physics : PCCP
|
December 1, 2010
Self-assembly of trehalose molecules on a lysozyme surface: the broken glass hypothesis
Maxim V Fedorov, Jonathan M Goodman, Dmitry Nerukh, et al.
Journal of Chemical Information and Modeling
|
December 28, 2018
Comparative Study of Multitask Toxicity Modeling on a Broad Chemical Space
Sergey Sosnin, Dmitry Karlov, Igor V Tetko, et al.
Molecular Pharmaceutics
|
July 28, 2015
Fast and General Method To Predict the Physicochemical Properties of Druglike Molecules Using the Integral Equation Theory of Molecular Liquids
David S Palmer, Maksim Mišin, Maxim V Fedorov, et al.
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
July 3, 2018
3D matters! 3D-RISM and 3D convolutional neural network for accurate bioaccumulation prediction
Sergey Sosnin, Maksim Misin, David S Palmer, et al.
ACS Omega
|
March 24, 2020
graphDelta: MPNN Scoring Function for the Affinity Prediction of Protein-Ligand Complexes
Dmitry S Karlov, Sergey Sosnin, Maxim V Fedorov, et al.
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 Theory and Computation
|
November 24, 2015
Solvent Binding Analysis and Computational Alanine Scanning of the Bovine Chymosin-Bovine κ-Casein Complex Using Molecular Integral Equation Theory
David S Palmer, Jesper Sørensen, Birgit Schiøtt, et al.
Page
of 6
Search research articles
Search
Showing results (21-30 of 56) with videos related to
Sort By:
Page
of 6
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
Chemical Reviews
|
June 16, 2015
Solvation thermodynamics of organic molecules by the molecular integral equation theory: approaching chemical accuracy
Ekaterina L Ratkova, David S Palmer, Maxim V Fedorov
Scientific Reports
|
July 21, 2021
Transformer-based artificial neural networks for the conversion between chemical notations
Lev Krasnov, Ivan Khokhlov, Maxim V Fedorov, et al.
Physical Chemistry Chemical Physics : PCCP
|
December 1, 2010
Self-assembly of trehalose molecules on a lysozyme surface: the broken glass hypothesis
Maxim V Fedorov, Jonathan M Goodman, Dmitry Nerukh, et al.
Journal of Chemical Information and Modeling
|
December 28, 2018
Comparative Study of Multitask Toxicity Modeling on a Broad Chemical Space
Sergey Sosnin, Dmitry Karlov, Igor V Tetko, et al.
Molecular Pharmaceutics
|
July 28, 2015
Fast and General Method To Predict the Physicochemical Properties of Druglike Molecules Using the Integral Equation Theory of Molecular Liquids
David S Palmer, Maksim Mišin, Maxim V Fedorov, et al.
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
July 3, 2018
3D matters! 3D-RISM and 3D convolutional neural network for accurate bioaccumulation prediction
Sergey Sosnin, Maksim Misin, David S Palmer, et al.
ACS Omega
|
March 24, 2020
graphDelta: MPNN Scoring Function for the Affinity Prediction of Protein-Ligand Complexes
Dmitry S Karlov, Sergey Sosnin, Maxim V Fedorov, et al.
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 Theory and Computation
|
November 24, 2015
Solvent Binding Analysis and Computational Alanine Scanning of the Bovine Chymosin-Bovine κ-Casein Complex Using Molecular Integral Equation Theory
David S Palmer, Jesper Sørensen, Birgit Schiøtt, et al.
Page
of 6