Spatio-Spectral Graph Neural Networks (S²GNN)
☆19Feb 25, 2025Updated last year
Alternatives and similar repositories for s2gnn
Users that are interested in s2gnn are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Investigating the benefit of relating river gauging stations via graph neural networks for flood forecasting☆16Mar 31, 2025Updated last year
- Cluster-Normalize-Activate Modules☆13Jan 13, 2025Updated last year
- Code and data for paper named: Large language models for automatic equation discovery of nonlinear dynamics☆13Mar 6, 2025Updated last year
- Official implementation of Spectro-Riemannian Graph Neural Networks (ICLR 2025)☆17May 30, 2025Updated 10 months ago
- [ICML 2025 GenBio Workshop] Official Implementation for "Electrostatics from Laplacian Eigenbasis for Neural Network Interatomic Potentia…☆17Jun 12, 2025Updated 10 months ago
- Wordpress hosting with auto-scaling - Free Trial • AdFully Managed hosting for WordPress and WooCommerce businesses that need reliable, auto-scalable performance. Cloudways SafeUpdates now available.
- Sum-of-Gaussians Neural Network (SOG-Net) is a lightweight and versatile framework for integrating long-range interactions into machine l…☆32Dec 23, 2025Updated 3 months ago
- ☆18Jan 7, 2026Updated 3 months ago
- Implementation of deep kernels in GPyTorch and Pyro☆13Jan 19, 2021Updated 5 years ago
- Efficient misspecification uncertainties for linear regression☆17Apr 6, 2026Updated last week
- Official Implementation of "Graph Neural Network-Inspired Kernels for Gaussian Processes in Semi-Supervised Learning"☆18Feb 11, 2023Updated 3 years ago
- Public releases of the NeuralIL differentiable neural-network force field☆14Sep 10, 2024Updated last year
- Metadynamics code on the G-space.☆15Jan 14, 2026Updated 3 months ago
- This is the reference implementation of our NeurIPS 2023 paper "Add and Thin: Diffusion for Temporal Point Processes"☆22Mar 4, 2024Updated 2 years ago
- Official repository for the paper "Higher-Rank Irreducible Cartesian Tensors for Equivariant Message Passing".☆18Dec 4, 2025Updated 4 months ago
- Virtual machines for every use case on DigitalOcean • AdGet dependable uptime with 99.99% SLA, simple security tools, and predictable monthly pricing with DigitalOcean's virtual machines, called Droplets.
- Graph Attention Networks in Tensorflow 2.0☆13Sep 8, 2019Updated 6 years ago
- A flexible and performant framework for training machine learning potentials.☆36Updated this week
- Pytorch Implementation of an A-RNN-LM☆13Feb 7, 2019Updated 7 years ago
- Fast, Expressive SE(n) Equivariant Networks through Weight-Sharing in Position-Orientation Space.☆91May 30, 2024Updated last year
- Official Pytorch implementation of NeuralWalker (ICLR 2025)☆39Jun 25, 2025Updated 9 months ago
- An implementation of SchNet in JAX and JAX-MD.☆17Apr 5, 2022Updated 4 years ago
- ☆25Apr 3, 2024Updated 2 years ago
- Graph revised convolutional network (ECML-PKDD 2020)☆16Oct 14, 2020Updated 5 years ago
- Main code for "Revisiting over-smoothing and over-squashing using the Ollivier-Ricci curvature" paper☆18May 30, 2023Updated 2 years ago
- Virtual machines for every use case on DigitalOcean • AdGet dependable uptime with 99.99% SLA, simple security tools, and predictable monthly pricing with DigitalOcean's virtual machines, called Droplets.
- Adaptive sampling algorithms for molecular transitions☆26Apr 10, 2026Updated last week
- Molecular Dynamic Graph Neural Network☆20Aug 5, 2021Updated 4 years ago
- Official Repository of Adaptive Message Passing☆20Jul 7, 2025Updated 9 months ago
- [ICLR 2025] Official Implementation of "Towards Fast, Specialized Machine Learning Force Fields: Distilling Foundation Models via Energy …☆25Apr 17, 2025Updated last year
- ☆14Nov 20, 2024Updated last year
- SpoT-Mamba: Learning Long-Range Dependency on Spatio-Temporal Graphs with Selective State Spaces (To appear in Spatio-Temporal Reasoning …☆47Jan 6, 2025Updated last year
- Transformer-based Spectral Graph Neural Networks☆85Oct 7, 2024Updated last year
- Rapid construction of chemical pipelines in interactive notebooks and cli usage☆13Sep 27, 2024Updated last year
- Repository to host supporting information and code samples for Accelerated DFT☆37Apr 29, 2025Updated 11 months ago
- Wordpress hosting with auto-scaling - Free Trial • AdFully Managed hosting for WordPress and WooCommerce businesses that need reliable, auto-scalable performance. Cloudways SafeUpdates now available.
- This repo contains the datasets used for the paper The Design Space of E(3)-Equivariant Atom-Centered Interatomic Potentials.☆20Aug 30, 2022Updated 3 years ago
- Benchmarking uncertainty quantification methods on proteins.☆21Jan 28, 2025Updated last year
- PySCF with auto-differentiation☆95Apr 10, 2026Updated last week
- ☆10Feb 12, 2025Updated last year
- Multimodal encoder-only transformer model for image-based protein predictions☆15Dec 12, 2023Updated 2 years ago
- An efficient and fully parallelized pure python DFT and electronic structure code with GPU acceleration☆60Updated this week
- Weather4Cast 2023 NeurIPS Competition - RainAI☆16Dec 4, 2023Updated 2 years ago