Semen Yesylevskyy
Co-founder And Chief Scientific Officer at IOCB Prague - Institute of Organic Chemistry and Biochemistry of the Czech Academy of Sciences
Prague, Prague, Czechia
Summary
👤
Senior🎓
Top SchoolSemen Yesylevskyy is a molecular modeling and theoretical biophysics expert with over a decade of experience translating molecular dynamics into practical drug discovery pipelines. As Co-founder and Chief Scientific Officer at Receptor.AI and a researcher at IOCB Prague and Palacký University, he leads development of AI-driven in silico methods to evaluate drug permeability and selectivity. He holds a PhD and a Doctor of Science (habilitation) and has pioneered MD techniques for highly curved and asymmetric lipid membranes, revealing how curvature and composition affect drug permeation. Semen is the author of open-source molecular modeling libraries Pteros and MolAR, underscoring his commitment to reproducible scientific software. His work bridges deep academic research—spanning polarizable coarse-grained models to ensemble docking—with startup-focused productization, making complex biophysical insight actionable for drug discovery. Colleagues often note his accentuated pronunciation (SemEn) as a small but memorable trademark of a thoughtful scientist-entrepreneur.
13 years of coding experience
1 year of employment as a software developer
Master's degree, Physics, Master's degree, Physics at National University of Kyiv-Mohyla Academy
Stackoverflow
1reputation
216reached
0answers
1question
Github Skills (59)
python10
logging10
cpp10
algebra9
molecular-simulation9
cffi9
spectral9
linux9
parsing9
polar-coordinates9
chemistry9
spdlog9
fenics8
matrix8
pypi8
Programming languages (8)
Github contributions (5)
yesint/pteros
Dec 2012 - Jan 2023
Modern and fast molecular analysis and modeling library for C++ and Python
Contributions:1 review, 1260 commits, 13 PRs in 10 years 2 months
cpppythonmolecular-modelingmolecular-analysismd-data-analysis
yesint/molar
Dec 2022 - Jul 2026
Repository for molar crate and its dependencies
Contributions:577 pushes, 6 branches, 6 tags in 3 years 7 months
cratemolecular-dynamicsmolecular-dynamics-simulationmolecular-modelingtrajectory-analysis
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