Starred repositories
Official PyTorch implementation for "A Theory for Conditional Generative Modeling on Multiple Data Sources"
ReQFlow: Rectified Quaternion Flow for Efficient and High-Quality Protein Backbone Generation
colbyford / bioemu
Forked from microsoft/bioemuInference code for scalable emulation of protein equilibrium ensembles with generative deep learning
oxpig / ImmuneBuilder
Forked from brennanaba/ImmuneBuilderPredict the structure of immune receptor proteins
Inference code for scalable emulation of protein equilibrium ensembles with generative deep learning
Official code for "Maximum Likelihood Training for Score-Based Diffusion ODEs by High-Order Denoising Score Matching" (ICML 2022)
BARNN: A Bayesian Autoregressive and Recurrent Neural Network - Official Repository
Score-Based Diffusion Policy Compatible with Reinforcement Learning via Optimal Transport
An Easy-to-use, Scalable and High-performance RLHF Framework (70B+ PPO Full Tuning & Iterative DPO & LoRA & RingAttention & RFT)
Sidechain conditioning and modeling for full-atom protein sequence design
Differentiable Optimizers with Perturbations in Pytorch
Implementation of DiffPack: A Torsional Diffusion Model for Autoregressive Protein Side-Chain Packing
Official PyTorch implementation for "Large Language Diffusion Models"
CALPHAD tools for designing thermodynamic models, calculating phase diagrams and investigating phase equilibria.
Every Call is Precious: Global Optimization of Black-Box Functions with Unknown Lipschitz Constants
Molecular dynamics simulations with an LLM agent
ICLR25 | Official code base for Denoising Levy Probabilistic Models (DLPM)
Repository for Piecewise Deterministic Generative Models
Python implementation of Empirical Mode Decompoisition (EMD) method
Python package for Bayesian Machine Learning with scikit-learn API