Jasper Butcher's repositories
chemistry-ai-research-team
Developement code for orchestrating LLMs to do research for you. Designed for computational amorphous chemistry, using machine learning pair potentials
DigitRecognizer
For kaggle competition on MNIST classification
awesome-molecular-generation
Awesome papers related to generative molecular modeling and design.
Dynamic-Protein-Viewer
Provides interface for displaying changes to 3d protein structures.
llms-for-lammps
Uses llms to design experiments to submit to lammps. Runs repeatedly to get toward some structure.
python-ace-interface
A simple set of scripts for interfacing with the Julia code required to compute ACE (Atomic Cluster Expansion) descriptors (See ACEsuit for original Julia code: https://github.com/ACEsuit/ACEpotentials.jl))
ttc-ai-research-team
Code for writing blog posts for thetensorcollective.com
torchdyn
A PyTorch library entirely dedicated to neural differential equations, implicit models and related numerical methods