greg-rezo's Stars
AlBi-HHU/myopic-mces
wroberts/pytimeparse
A small Python module to parse various kinds of time expressions.
carbonscott/pymolPy3
The package enables the use of PyMOL commands directly in Python 3 scripts.
rtg-wispermed/BioKGrapher
BioKGrapher Toolset
wenhao-gao/synformer
kedro-org/kedro
Kedro is a toolbox for production-ready data science. It uses software engineering best practices to help you create data engineering and data science pipelines that are reproducible, maintainable, and modular.
jrwnter/cddd
Implementation of the Paper "Learning Continuous and Data-Driven Molecular Descriptors by Translating Equivalent Chemical Representations" by Robin Winter, Floriane Montanari, Frank Noe and Djork-Arne Clevert.
deepmirror/small-mol-gen
NVIDIA/MegaMolBART
A deep learning model for small molecule drug discovery and cheminformatics based on SMILES
RosettaCommons/rosetta
The Rosetta Bio-macromolecule modeling package.
gfzhou/OpenVS
Codes and scripts for "An artificial intelligence accelerated virtual screening platform for drug discovery"
bklieger-groq/stockbot-on-groq
StockBot powered by Groq: Lightning Fast AI Chatbot that Responds With Live Interactive Stock Charts, Financials, News, Screeners, and More. Powered by Llama3-70b on Groq, Vercel AI SDK, and TradingView Widgets.
google-deepmind/dm-haiku
JAX-based neural network library
facebook/Ax
Adaptive Experimentation Platform
pinder-org/pinder
PINDER: The Protein INteraction Dataset and Evaluation Resource