interest

Molecular modeling

Komarov Pavel
DSc in Physics and Mathematics, Associate Professor
INEOS RAS
INEOS RAS
TSU
TSU
102 publications,  1 034 citations
h-index: 16
Research interests
Physical Chemistry
Computational chemistry
Nanotechnology
Molecular modeling
Computer simulation
Soft environments
Soft matter
R&D
Toukach Philip
🥼 🤝
DSc in Chemistry, Associate Professor
ZIOC RAS
ZIOC RAS
NRU HSE
NRU HSE
89 publications,  2 948 citations
h-index: 24
Research interests
Chemoinformatics
Bioinformatics
Data Science
Molecular phylogenetics
Molecular modeling
NMR spectroscopy
Databases
Glycobiology
Visualization in chemistry
Gushchin Ivan
🥼 🤝
PhD in Physics and Mathematics
MIPT
MIPT
76 publications,  1 608 citations
h-index: 22
Research interests
Bioinformatics
Molecular modeling
The structure of proteins
Protein Engineering
Tyurin Daniil
PhD in Chemistry
MSU
MSU
64 publications,  600 citations
h-index: 13
Research interests
Physical Chemistry
Quantum Chemistry
Computational chemistry
Spectroscopy
Molecular modeling
Space research
Photochemistry
Chemical Physics
Non-covalent Interactions
Non-valent interactions
EPR spectroscopy
Astrophysics
IR spectroscopy
Cryogenic technology
High-performance computing
X-ray radiation
Reaction mechanisms
Ab initio
Singlet oxygen
Molecular spectroscopy
Computational methods in chemistry
Matrix isolation
Matrix isolation
Interaction of X-ray and synchrotron radiation with matter
Chugunov Anton
🥼 🤝
PhD in Physics and Mathematics
IBCh RAS
IBCh RAS
MIPT
MIPT
54 publications,  1 030 citations
h-index: 18
Research interests
Biochemistry
Molecular modeling
Structural Biology
Ion channels
Molecular dynamics
Membrane proteins
Membrane receptors
Khramtsova Ekaterina
🥼 🤝
PhD in Chemistry
PSU
PSU
45 publications,  214 citations
h-index: 8
Research interests
Organic Chemistry
Medicinal Chemistry
Molecular modeling
Molecular docking
Antioxidants
Antibiotics
Rusalev Yuri
SFedU
SFedU
38 publications,  391 citations
h-index: 11
Research interests
Machine Learning
Molecular modeling
Computer simulation
Molecular dynamics
Kondratyuk Nikolay
🥼 🤝
PhD in Physics and Mathematics
MIPT
MIPT
NRU HSE
NRU HSE
JIHT RAS
JIHT RAS
36 publications,  399 citations
h-index: 11
Research interests
Molecular modeling
Computer simulation
Molecular dynamics
Bogdanova Yuliya
PhD in Physics and Mathematics
NRNU MEPhI
NRNU MEPhI
29 publications,  112 citations
h-index: 6
Research interests
Thermodynamics
Molecular modeling
Odintsova Ekaterina
PhD in Chemistry
NRU HSE
NRU HSE
ISC RAS
ISC RAS
25 publications,  110 citations
h-index: 6
Research interests
Molecular modeling
Molecular dynamics
Structural and dynamic properties of molecular and ion-molecular systems in a wide range of state parameters
Mozhaitsev Evgenii
PhD in Chemistry
NIOC SB RAS
NIOC SB RAS
24 publications,  171 citations
h-index: 9
Research interests
Organic Chemistry
Medicinal Chemistry
Molecular modeling
Larionov Konstantin
🥼 🤝
PhD in Physics and Mathematics
MISiS
MISiS
23 publications,  214 citations
h-index: 8
Research interests
Materials science
Machine Learning
Molecular modeling
Carbon materials
Spintronics
Density functional theory (DFT)
2D Materials
Solid State Physics
Tsygankov Artem
KFU
KFU
UFRC UB RAS
UFRC UB RAS
4 publications,  1 citation
h-index: 1
Research interests
Computational Physics
Molecular modeling
Density functional theory (DFT)
Computer Science
High-performance computing
Pytnon
Potapov Denis
MIPT
MIPT
Skoltech
Skoltech
4 publications,  22 citations
h-index: 2
Research interests
Molecular modeling
Computer simulation
Molecular dynamics
Mulashkina Tatiana
MSU
MSU
IBCP RAS
IBCP RAS
3 publications,  1 citation
h-index: 1
Research interests
Biochemistry
Quantum Chemistry
Machine Learning
Bioinformatics
Molecular modeling
Molecular dynamics
Ivanov Nikolay
🤝
RSAU-MTAA
RSAU-MTAA
2 publications
h-index: 0
Research interests
Molecular phylogenetics
Molecular modeling
Chaliy Vasiliy
🥼
ZIOC RAS
ZIOC RAS
BMSTU
BMSTU
2 publications,  3 citations
h-index: 1
Research interests
Molecular modeling
Density functional theory (DFT)
Gordeev Kirill
🔍
KubSMU
KubSMU
2 publications,  1 citation
h-index: 1
Research interests
Biotechnology
Medicinal Chemistry
Molecular modeling
Molecular docking
Pharmaceutical technology