355 dependents
| Package | Description | Downloads/month |
|---|---|---|
| SevenNet - a graph neural network interatomic potential package supporting effic... | 445K | |
| MatterSim: A deep learning atomistic model across elements, temperatures and pre... | 418K | |
| Implementation of Alphafold 3 from Google Deepmind in Pytorch | 28K | |
| MatGL is a framework for graph deep learning for materials science. | 27K | |
| A project which aims to abstract the analysis pipeline of a Particle Physics Ana... | 20K | |
| Implementation of MeshGPT, SOTA Mesh generation using Attention, in Pytorch | 16K | |
| diffusion models for material generation | 14K | |
| A PyTorch library and evaluation platform for end-to-end compression research | 14K | |
| A package to hold various functions to support training of ML models. | 11K | |
| SpaMV: An interpretable spatial multi-omics data integration and dimension reduc... | 8K | |
| PyTorch Geometric Temporal: Spatiotemporal Signal Processing with Neural Machine... | 8K | |
| A package to build graphs for data-driven forecasts. | 7K | |
| PINDER: The Protein INteraction Dataset and Evaluation Resource | 7K | |
| Biomolecular emulator | 6K | |
| AI Agents for drug discovery, drug development, and other pharmaceutical R&D. | 6K | |
| A package to hold various functions to support training of ML models. | 5K | |
| spaCR Spatial phenotype analysis of CRISPR–Cas9 screens (spaCR) | 5K | |
| Ordered Niche Trajectory Construction | 5K | |
| Knowledge graph embedding library bridging encoders from PyG and decoders from T... | 4K | |
| Deeplay is a deep learning library in Python that extends PyTorch with additiona... | 4K | |
| Open-source Python client for deploying machine learning models and obtaining pr... | 4K | |
| Physics-Informed Neural networks for Advanced modeling | 3K | |
| Benchmarking LLM Retrieval on Textual and Relational Knowledge Bases | 3K | |
| A fully local, pip-installable RL-powered cyber pentesting simulation framework ... | 3K | |
| plyze: floor PLan analYZEr | 3K | |
| An Extension Library for PyTorch Geometric on signed and directed networks. | 3K | |
| A Library of Imputation Techniques for Time Series Data | 3K | |
| Meteo-France's Artificial Intelligence Python Package | 3K | |
| BioTarget: AI Drug Discovery Pipeline. Requires NVIDIA GPU and Docker for GNINA ... | 3K | |
| Graphium: Scaling molecular GNNs to infinity. | 3K | |
| Utilities for computer vision and 3D geometry | 2K | |
| Graph-based foundation model for spatial transcriptomics data. Zero-shot spatial... | 2K | |
| Temporal Graph Benchmark project repo | 2K | |
| Machine Learning Research Wizard | 2K | |
| A torch implementation of GFlowNets | 2K | |
| CDVAE property model evaluation for crystal structures | 2K | |
| A deep-learning based multi-omics bulk sequencing data integration suite with a ... | 2K | |
| Point Cloud Deep Learning Extension Library for PyTorch | 2K | |
| MEGAN: Multi Explanation Graph Attention Network | 2K | |
| 2K | ||
| Hom-/Heter-ophilic Graphs Datasets | 2K | |
| A unified framework for LLM routing and evaluation. | 2K | |
| Implementation of AlphaFold 3 in PyTorch Lightning + Hydra | 2K | |
| A Python Package for Deep Graph Networks | 2K | |
| Doc2Graph transforms documents into graphs and exploit a GNN to solve several ta... | 2K | |
| An example package | 2K | |
| CALM-Data-Generator is a comprehensive Python library for synthetic data generat... | 2K | |
| A python package designed to communicate among various chemical and materials ca... | 2K | |
| Universal Hyperbolic Geometry library for machine learning (projective UHG, hype... | 2K | |
| STACCI for STCase | 2K |
