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MSU Chemistry Faculty
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List of single-file C/C++ libraries, with emphasis on clause-less licenses.
Outline Client and Manager, developed by Jigsaw. Outline Manager makes it easy to create your own VPN server. Outline Client lets you share access to your VPN with anyone in your network, giving th…
Example of permanent SSH tunnel using libssh2
Open-source Windows and Office activator featuring HWID, Ohook, TSforge, KMS38, and Online KMS activation methods, along with advanced troubleshooting.
🐜 single header process launching solution for C and C++
An Experimental Python Wrapper For Tradingview's Lightweight-Charts To Be Used In Notebook Environments (Google Colab).
Code to support the paper: P. van Gerwen, K. R. Briling, C. Bunne, V. R. Somnath, R. Laplaza, A. Krause, C. Corminboeuf, "3DReact: Geometric Deep Learning for Chemical Reactions", J. Chem. Inf. Mod…
The Python ensemble sampling toolkit for affine-invariant MCMC
MBX is an energy and force calculator for data-driven many-body simulations.
High-performance automatic differentiation of LLVM and MLIR.
deepqmc / ferminet
Forked from google-deepmind/ferminetAn implementation of the Fermionic Neural Network for ab-initio electronic structure calculations
repository and website for tutorials on 3d Euclidean equivariant neural networks
library to read/write .npy and .npz files in C/C++
A collection of resources regarding the interplay between differential equations, deep learning, dynamical systems, control and numerical methods.
ALPES: Stochastic active learning of potential energy surfaces.
Richmol is for variational simulations of molecular nuclear motion dynamics in fields
NequIP is a code for building E(3)-equivariant interatomic potentials