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Computational Chemist PhD | Molecular Machine Learning | Cheminformatics | Scientific Python Programming
PhD computational scientist with a strong focus on molecular machine learning, graph neural
networks (GNNs), and high-performance scientific computing. Proven track record in designing
and deploying end-to-end, hardware-agnostic ML pipelines (PyTorch/PyTorch Geometric). Expert
in translating complex scientific problems into scalable computational architectures with a focus
on reproducibility, CI/CD, and "first-class" software engineering standards.
About
Computational Physical Chemistry | RDKit Cheminformatics | MILIA Python Software Developer
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