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1. facebookresearch/wt-asbsfacebookresearch/wt-asbsPublic

   Code for “Enhancing Diffusion-Based Sampling with Molecular Collective Variables"

   Python 23 2

2. facebookresearch/adjoint_samplingfacebookresearch/adjoint_samplingPublic

   code for "Adjoint Sampling: Highly Scalable Diffusion Samplers via Adjoint Matching"

   Python 140 12

3. omri1348/SGFMomri1348/SGFMPublic

   Official implementation of "Space Group Conditional Flow Matching".

   Python 3

4. facebookresearch/flowmmfacebookresearch/flowmmPublic archive

   Code for “FlowMM Generating Materials with Riemannian Flow Matching” and "FlowLLM: Flow Matching for Material Generation with Large Language Models as Base Distributions"

   Python 185 38

5. e3nn/e3nne3nn/e3nnPublic

   A modular framework for neural networks with Euclidean symmetry

   Python 1.3k 185

6. undark-lab/swyftundark-lab/swyftPublic

   A system for scientific simulation-based inference at scale.

   Jupyter Notebook 172 19