- 🔭 Currently working as Chemistry Data Tech Lead within the pharmaceutical industry.
- 🌱 On my way to expand my data structure, algorithms, and cryptography knowledge.
- 👯 Building protocols on Ethereum.
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Physics and technology enthusiast. Ethereum Buidler.
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AstraZeneca/jazzy
AstraZeneca/jazzy PublicFast calculation of hydrogen-bond strengths and free energy of hydration of small molecules.
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AstraZeneca/kallisto
AstraZeneca/kallisto PublicEfficiently calculate 3D-features for quantitative structure-activity relationship approaches.
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C-H-activation/ICB-workflow
C-H-activation/ICB-workflow PublicSoBo regioselectivity model for the iridium-catalyzed borylation.
Python 2
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grimme-lab/xtb
grimme-lab/xtb PublicSemiempirical Extended Tight-Binding Program Package
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dftd4/dftd4
dftd4/dftd4 PublicGenerally Applicable Atomic-Charge Dependent London Dispersion Correction
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