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Python 71 4 Updated Oct 10, 2024

Official implementation of "MeshDiffusion: Score-based Generative 3D Mesh Modeling" (ICLR 2023 Spotlight)

Python 803 44 Updated May 20, 2024

Examples of Verbalized Machine Learning (VML)

Python 11 2 Updated Jul 26, 2024

A Text-guided Protein Design Framework, Nat Mach Intell 2025

Python 53 4 Updated Jan 11, 2025

[NeurIPS 2024 Best Paper][GPT beats diffusion🔥] [scaling laws in visual generation📈] Official impl. of "Visual Autoregressive Modeling: Scalable Image Generation via Next-Scale Prediction". An *ult…

Jupyter Notebook 6,645 435 Updated Jan 12, 2025

A generative world for general-purpose robotics & embodied AI learning.

Python 23,990 2,066 Updated Feb 21, 2025

NeuralMD for protein-ligand binding simulation

Python 11 1 Updated Jan 11, 2025

List of molecules (small molecules, RNA, peptide, protein, enzymes, antibody, and PPIs) conformations and molecular dynamics (force fields) using generative artificial intelligence and deep learning

146 14 Updated Feb 20, 2025

Quantum dynamics latent neural ode

Python 20 1 Updated May 26, 2022

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

Python 108 17 Updated Oct 29, 2024
1 Updated Oct 29, 2024

PyTorch code and models for V-JEPA self-supervised learning from video.

Python 2,793 266 Updated Aug 9, 2024

Official Pytorch Implementation of Representation Alignment for Generation: Training Diffusion Transformers Is Easier Than You Think (ICLR 2025)

Python 832 40 Updated Jan 28, 2025

ORB forcefield models from Orbital Materials

Python 288 39 Updated Feb 6, 2025

Rotary Transformer

Python 895 52 Updated Mar 21, 2022

ICML23 "Latent Traversals in Generative Models as Potential Flows"

Python 26 2 Updated Oct 23, 2023

High-Resolution Image Synthesis with Latent Diffusion Models

Jupyter Notebook 12,374 1,574 Updated Feb 29, 2024

Different utilities used by our group

Python 9 2 Updated Nov 29, 2024

awesome papers in LLM interpretability

403 12 Updated Jan 14, 2025

FoldFlow: SE(3)-Stochastic Flow Matching for Protein Backbone Generation

Jupyter Notebook 207 15 Updated Dec 10, 2024

OFFICIAL: AnteChamber PYthon Parser interfacE

Python 216 50 Updated Jan 20, 2025

Computing the Committor with the Committor: an Anatomy of the Transition State Ensemble

Forth 10 Updated Jul 12, 2024

High accuracy RAG for answering questions from scientific documents with citations

Python 6,973 687 Updated Feb 22, 2025

Evaluation dataset for AI systems intended to benchmark capabilities foundational to scientific research in biology

Python 33 2 Updated Feb 18, 2025

Multi-modal conditioning diffusion model for MOFs generation

Jupyter Notebook 21 4 Updated Feb 3, 2025

Python module for quantum chemistry

Python 1,306 603 Updated Feb 16, 2025

Unsupervised Discovery of Steerable Factors When Graph Deep Generative Models Are Entangled, TMLR 2024

Python 4 2 Updated Jul 19, 2024

CARE: a Benchmark Suite for the Classification and Retrieval of Enzymes

Jupyter Notebook 31 Updated Jan 26, 2025

Annotated Flow Matching paper

Jupyter Notebook 173 7 Updated Sep 14, 2024
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