☆19Mar 14, 2023Updated 3 years ago
Alternatives and similar repositories for torch_nl
Users that are interested in torch_nl are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Compute neighbor lists for atomistic systems☆85Updated this week
- CUDA implementations of MACE models☆22Aug 19, 2025Updated last year
- Pure C implementation of e3nn☆25Mar 17, 2025Updated last year
- LES extension package for NequIP☆21Aug 14, 2026Updated 3 weeks ago
- Tools for geometric learning☆12Sep 26, 2025Updated 11 months ago
- Serverless GPU API endpoints on Runpod - Get Bonus Credits • AdSkip the infrastructure headaches. Auto-scaling, pay-as-you-go, no-ops approach lets you focus on innovating your application.
- An ASE-friendly implementation of the amorphous-to-crystalline (a2c) workflow.☆18Oct 19, 2025Updated 10 months ago
- ☆22May 7, 2025Updated last year
- ☆18Feb 26, 2026Updated 6 months ago
- Self-describing sparse tensor data format for atomistic machine learning and beyond☆108Updated this week
- Tools for building equivariant polynomials on reductive Lie groups.☆38Jun 29, 2023Updated 3 years ago
- A library to align rigid molecules and clusters☆13Updated this week
- Higher order equivariant graph neural networks for 3D point clouds☆49Jun 27, 2023Updated 3 years ago
- Permutation Equivariant Lorentz Invariant/Covariant Aggregator Network☆14Oct 28, 2024Updated last year
- PyTorch-based auto-differentiable orbital-free density functional theory package☆12Aug 7, 2026Updated last month
- Managed Kubernetes at scale on DigitalOcean • AdDigitalOcean Kubernetes includes the control plane, bandwidth allowance, container registry, automatic updates, and more for free.
- ☆48Aug 25, 2026Updated last week
- Alchemical machine learning interatomic potentials☆39Nov 8, 2024Updated last year
- ☆11Sep 16, 2024Updated last year
- 🌟 [NeurIPS '25 Spotlight] Fair and transparent benchmark of machine learning interatomic potentials (MLIPs), beyond basic error metrics …☆106Jul 2, 2026Updated 2 months ago
- Efficient and easy to use fortran implementation of the Ewald summation method☆19Jun 27, 2023Updated 3 years ago
- ASE calculator wrapper for g-xTB☆28Jul 4, 2025Updated last year
- Allegro-pol extends the Allegro architecture to model the electric response of materials☆41May 30, 2026Updated 3 months ago
- Benchmarking foundation Machine Learning Potentials with Lattice Thermal Conductivity from Anharmonic Phonons☆15Oct 30, 2024Updated last year
- Multi-language library for the calculation of spherical harmonics in Cartesian coordinates☆103Jul 9, 2026Updated last month
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- ☆17Jul 23, 2026Updated last month
- OpenEquivariance: a fast, open-source GPU JIT kernel generator for the Clebsch-Gordon Tensor Product.☆165Updated this week
- ML Performance and Extrapolation Guide (reference deployment https://ml-peg.stfc.ac.uk)☆60Updated this week
- Heat-conductivity benchmark test for foundational machine-learning potentials☆30Jun 28, 2026Updated 2 months ago
- A python library for replica exchange transition interface sampling with infinite swaps☆16May 26, 2026Updated 3 months ago
- ☆17Apr 22, 2025Updated last year
- LAMMPS pair styles for NequIP and Allegro deep learning interatomic potentials☆65May 15, 2026Updated 3 months ago
- Fortran 2003 interface bindings to POSIX Threads.☆11Jun 5, 2020Updated 6 years ago
- [TMLR 2023] Training and simulating MD with ML force fields☆115Oct 30, 2024Updated last year
- Managed Database hosting by DigitalOcean • AdPostgreSQL, MySQL, MongoDB, Kafka, Valkey, and OpenSearch available. Automatically scale up storage and focus on building your apps.
- ☆35Jun 17, 2026Updated 2 months ago
- A Sobol sequence generator for Scala and Javascript☆15Feb 15, 2020Updated 6 years ago
- Continual Resilient (CoRe) Optimizer for PyTorch☆12Jun 10, 2024Updated 2 years ago
- Code for the paper titled "The Design Space of E(3)-Equivariant Atom-Centered Interatomic Potentials".☆18Nov 7, 2024Updated last year
- ☆27Jul 16, 2026Updated last month
- Ab-initio Interface Materials Simulation Project for Grain Boundaries (AIMSGB)☆74Mar 15, 2024Updated 2 years ago
- Collection of tutorials to use the MACE machine learning force field.☆73Jul 13, 2026Updated last month