ANTIPASTI (ANTIbody Predictor of Affinity from STructural Information) is a Deep Learning model that predicts the binding affinity of antibodies from their three-dimensional structure.

Machine Learning Research Wizard

DIfferentiable MOlecular Simulator (DIMOS): A pyTorch based framework for machine-learning enhanced simulations

⚡ The Open Research Copilot. Build high-perf Portfolios, Lab Sites & Docs in Markdown + Jupyter. 100% Data Control. 🦫 数据科学家的开源 Copilot。一键部署 👇

🍦 Never use print() to debug again.

Geometric Algebra package for JAX

Python package for Geometric / Clifford Algebra with TensorFlow

Optimization with Constraint Learning (OCL) Lab

The official implementation for Pseudo Numerical Methods for Diffusion Models on Manifolds (PNDM, PLMS | ICLR2022)

Repo to the paper "Message Passing Neural PDE Solvers"

PDEBench: An Extensive Benchmark for Scientific Machine Learning