Search research articles
Contact Us
Filters
Showing results (1-10 of 9) with videos related to
Page
of 1
Sort By:
Journal of Computational Chemistry
|
September 5, 2002
Determination of the effective dielectric constant from the accurate solution of the Poisson equation
Vladislav Vasilyev
Computer Methods and Programs in Biomedicine
|
February 25, 2025
In silico tuning of binding selectivity for new SARS-CoV-2 main protease inhibitors
Feng Wang, Vladislav Vasilyev
Pharmaceuticals (Basel, Switzerland)
|
September 27, 2025
DFT Structural and UV-Vis Spectral Insights into Photosensitivity of Vandetanib: A Dual EGFR/SARS-CoV-2 Mpro Inhibitor
Feng Wang, Vladislav Vasilyev
Molecules (Basel, Switzerland)
|
May 27, 2026
The Far-IR Fe-Cp Vibrations of Deuterated Ferrocene: A DFT Benchmark and Physics-Based AI Assessment
Feng Wang, Vladislav Vasilyev
Journal of Computational Chemistry
|
April 12, 2002
A fast pairwise evaluation of molecular surface area
Vladislav Vasilyev, Enrico O Purisima
The Journal of Physical Chemistry. B
|
July 30, 2009
Methylation of zebularine: a quantum mechanical study incorporating interactive 3D pdf graphs
Lalitha Selvam, Vladislav Vasilyev, Feng Wang
Materials (Basel, Switzerland)
|
August 11, 2017
Ferrocene Orientation Determined Intramolecular Interactions Using Energy Decomposition Analysis
Feng Wang, Shawkat Islam, Vladislav Vasilyev
Molecules (Basel, Switzerland)
|
June 27, 2024
Insights into Halogen-Induced Changes in 4-Anilinoquinazoline EGFR Inhibitors: A Computational Spectroscopic Study
Sallam Alagawani, Vladislav Vasilyev, Andrew H A Clayton, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 5, 2023
A photoelectron spectroscopic investigation of aspirin, paracetamol and ibuprofen in the gas phase
Hanan Sa'adeh, Kevin C Prince, Robert Richter, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 9) with videos related to
Sort By:
Page
of 1
Journal of Computational Chemistry
|
September 5, 2002
Determination of the effective dielectric constant from the accurate solution of the Poisson equation
Vladislav Vasilyev
Computer Methods and Programs in Biomedicine
|
February 25, 2025
In silico tuning of binding selectivity for new SARS-CoV-2 main protease inhibitors
Feng Wang, Vladislav Vasilyev
Pharmaceuticals (Basel, Switzerland)
|
September 27, 2025
DFT Structural and UV-Vis Spectral Insights into Photosensitivity of Vandetanib: A Dual EGFR/SARS-CoV-2 Mpro Inhibitor
Feng Wang, Vladislav Vasilyev
Molecules (Basel, Switzerland)
|
May 27, 2026
The Far-IR Fe-Cp Vibrations of Deuterated Ferrocene: A DFT Benchmark and Physics-Based AI Assessment
Feng Wang, Vladislav Vasilyev
Journal of Computational Chemistry
|
April 12, 2002
A fast pairwise evaluation of molecular surface area
Vladislav Vasilyev, Enrico O Purisima
The Journal of Physical Chemistry. B
|
July 30, 2009
Methylation of zebularine: a quantum mechanical study incorporating interactive 3D pdf graphs
Lalitha Selvam, Vladislav Vasilyev, Feng Wang
Materials (Basel, Switzerland)
|
August 11, 2017
Ferrocene Orientation Determined Intramolecular Interactions Using Energy Decomposition Analysis
Feng Wang, Shawkat Islam, Vladislav Vasilyev
Molecules (Basel, Switzerland)
|
June 27, 2024
Insights into Halogen-Induced Changes in 4-Anilinoquinazoline EGFR Inhibitors: A Computational Spectroscopic Study
Sallam Alagawani, Vladislav Vasilyev, Andrew H A Clayton, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 5, 2023
A photoelectron spectroscopic investigation of aspirin, paracetamol and ibuprofen in the gas phase
Hanan Sa'adeh, Kevin C Prince, Robert Richter, et al.
Page
of 1