Anton Siomchen

Senior Software Engineer at EPAM Systems

Krakow, Lesser Poland Voivodeship
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Summary

👤
Senior
🎓
Top School
Anton Siomchen is a Senior Software Engineer blending a medicinal chemistry background with four years of hands-on experience in cheminformatics, computer-aided drug design, and chemical automation. Based in Krakow, he has advanced from intern roles in XDL data and CADD to developing and deploying molecular docking tools, novel chemical-space exploration algorithms, and APIs on AWS ECS and HPC at EPAM. His work uniquely bridges lab and code—automating compound generation with RDKit, integrating vina/smina/gnina workflows, and contributing to practical ontologies for translating digital procedures into molecules. Comfortable across ML, cloud deployment, and domain-specific tooling, he focuses on accelerating drug discovery pipelines and everyday healthcare impact through reproducible, production-ready software.
code4 years of coding experience
job2 years of employment as a software developer
bookMaster of Science - MS, Medicinal Chemistry, Master of Science - MS, Medicinal Chemistry at Uniwersytet Jagielloński w Krakowie
languagesPolish, Russian, English
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Github Skills (28)

python10
rdkit10
cheminformatics10
simulation9
docking9
reaction9
chemistry8
sqlalchemy8
extraction8
vectorization8
molecular-simulation8
materials-informatics7
mouseover7
interaction7
drug-discovery7

Programming languages (7)

C++CSSRustJavaScriptHTMLJupyter NotebookPython

Github contributions (5)

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asiomchen/scikit-mol

Dec 2024 - Sep 2025

scikit-learn classes for molecular vectorization using RDKit
Contributions:5 releases, 4 PRs, 81 pushes in 8 months
asiomchen/molharbor

Jun 2024 - Dec 2025

Unofficial Python wrapper for molport API
Contributions:8 releases, 13 PRs, 37 pushes in 1 year 6 months
python
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