Felix Pultar
pultar
Senior Research Scientist @ Microsoft Research | PhD and postdoctoral studies @ ETH Zurich.
Languages
Repos
26
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5
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2
Top Language
Python
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Repositories
26My website
RetroChimera: a frontier retrosynthesis model built on ensembling
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Graph Neural Network Based Implicit QM Solvent
md++ code
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Introduction to Computational Chemistry 2023 @ ETHZ
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PyTorch Extension Library of Optimized Graph Cluster Algorithms
Semiempirical Extended Tight-Binding Program Package
Enable cheminformatics and quantum chemistry
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Calculates the distance between two atoms in a GROMOS cnf file
Tensors and Dynamic neural networks in Python with strong GPU acceleration
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