☆48Aug 25, 2026Updated last week
Alternatives and similar repositories for symmetrix
Users that are interested in symmetrix are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- ☆27Jul 16, 2026Updated last month
- ML Performance and Extrapolation Guide (reference deployment https://ml-peg.stfc.ac.uk)☆60Updated this week
- CUDA implementations of MACE models☆22Aug 19, 2025Updated last year
- An ASE-friendly implementation of the amorphous-to-crystalline (a2c) workflow.☆18Oct 19, 2025Updated 10 months ago
- Machine-Learned Interatomic Potential eXploration (mlipx) is designed at BASF for evaluating machine-learned interatomic potentials (MLIP…☆107Jan 28, 2026Updated 7 months ago
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- Collection of tutorials to use the MACE machine learning force field.☆73Jul 13, 2026Updated last month
- Tools for machine learnt interatomic potentials☆51Aug 26, 2026Updated last week
- ☆18Feb 26, 2026Updated 6 months ago
- Benchmarking foundation Machine Learning Potentials with Lattice Thermal Conductivity from Anharmonic Phonons☆15Oct 30, 2024Updated last year
- Particle-mesh based calculations of long-range interactions in PyTorch☆81Aug 3, 2026Updated last month
- Compute neighbor lists for atomistic systems☆85Updated this week
- ☆17Jul 23, 2026Updated last month
- pytorch implementation of dftd2 & dftd3 (not actively maintained)☆108Aug 25, 2026Updated last week
- 🌟 [NeurIPS '25 Spotlight] Fair and transparent benchmark of machine learning interatomic potentials (MLIPs), beyond basic error metrics …☆105Jul 2, 2026Updated 2 months ago
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- Code for the paper titled "The Design Space of E(3)-Equivariant Atom-Centered Interatomic Potentials".☆18Nov 7, 2024Updated last year
- ☆59Aug 18, 2026Updated 2 weeks ago
- GRACE models and gracemaker (as implemented in TensorPotential package)☆106Updated this week
- MESS: Modern Electronic Structure Simulations☆44May 9, 2026Updated 3 months ago
- Auto-differentiated descriptors using Enzyme☆12Apr 2, 2025Updated last year
- Library for efficient training and application of Machine Learning Interatomic Potentials (MLIP)☆131Aug 4, 2026Updated last month
- python workflow toolkit☆43Aug 22, 2026Updated 2 weeks ago
- Reproduction of CGCNN for predicting material properties☆28Updated this week
- ☆35Jun 17, 2026Updated 2 months ago
- Bare Metal GPUs on DigitalOcean Gradient AI • AdPurpose-built for serious AI teams training foundational models, running large-scale inference, and pushing the boundaries of what's possible.
- Heat-conductivity benchmark test for foundational machine-learning potentials☆30Jun 28, 2026Updated 2 months ago
- Equivariant machine learning interatomic potentials in JAX.☆111Aug 10, 2026Updated 3 weeks ago
- Display and Edit Molecules (https://zndraw.icp.uni-stuttgart.de)☆50Updated this week
- Machine Learning Interatomic Potentials with the Atomic Cluster Expansion☆77Aug 21, 2026Updated 2 weeks ago
- DistMLIP: A Distributed Inference Library for Fast, Large Scale Atomistic Simulation☆98Sep 20, 2025Updated 11 months ago
- A python library for calculating materials properties from the PES☆150Updated this week
- Computing representations for atomistic machine learning☆82Jul 22, 2026Updated last month
- MACE-Field - Fast and accurate machine learning interatomic potentials under an external electric field for predicting dielectric propert…☆28Aug 27, 2026Updated last week
- Generate isosurface from density data☆15Aug 25, 2026Updated last week
- 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.
- ☆17Apr 22, 2025Updated last year
- Implementation of the Euclidean fast attention (EFA) algorithm☆103Jan 7, 2026Updated 7 months ago
- Pymatgen Core☆25Aug 30, 2026Updated last week
- Evaluation of universal machine learning force-fields https://doi.org/10.1021/acsmaterialslett.5c00093☆14Jul 8, 2025Updated last year
- MACE foundation models (MP, OMAT, mh-1)☆302Aug 26, 2026Updated last week
- Pretrained model for molecular wavefunctions☆64Aug 24, 2026Updated last week
- MACE - Fast and accurate machine learning interatomic potentials with higher order equivariant message passing.☆1,340Updated this week