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gusty1g's Projects

deepchem icon deepchem

Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology

dmol-book icon dmol-book

Deep learning for molecules and materials book

dqc icon dqc

Differentiable Quantum Chemistry (only Differentiable Density Functional Theory and Hartree Fock at the moment)

e3nn_tutorial icon e3nn_tutorial

repository and website for tutorials on 3d Euclidean equivariant neural networks

fastapi icon fastapi

FastAPI framework, high performance, easy to learn, fast to code, ready for production

gym icon gym

A toolkit for developing and comparing reinforcement learning algorithms.

invoke-atomicredteam icon invoke-atomicredteam

Invoke-AtomicRedTeam is a PowerShell module to execute tests as defined in the [atomics folder](https://github.com/redcanaryco/atomic-red-team/tree/master/atomics) of Red Canary's Atomic Red Team project.

jest icon jest

Delightful JavaScript Testing.

numpy icon numpy

The fundamental package for scientific computing with Python.

openmm icon openmm

OpenMM is a toolkit for molecular simulation using high performance GPU code.

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