☆22May 7, 2025Updated last year
Alternatives and similar repositories for allegro-jax
Users that are interested in allegro-jax are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- ☆25Nov 1, 2023Updated 2 years ago
- JAX implementation of the NequIP neural network interatomic potential☆17Feb 24, 2026Updated 7 months ago
- Equivariant machine learning interatomic potentials in JAX.☆113Aug 10, 2026Updated last month
- Annotated implementations of equivariant (graph) neural networks in Jax: EGNN, SEGNN, NequIP.☆44Mar 1, 2025Updated last year
- Steerable E(3) GNN in jax☆24Oct 1, 2023Updated 2 years ago
- Simple, predictable pricing with DigitalOcean hosting • AdAlways know what you'll pay with monthly caps and flat pricing. Enterprise-grade infrastructure trusted by 600k+ customers.
- An ASE-friendly implementation of the amorphous-to-crystalline (a2c) workflow.☆18Oct 19, 2025Updated 11 months ago
- [ICML'26] Phonon fine-tuning (PFT) and [NeurIPS'25 AI4Mat] Nequix: Training a foundation model for materials on a budget☆77Apr 5, 2026Updated 5 months ago
- A library for building equivariant neural networks and a zoo of implementations & examples.☆31Aug 9, 2022Updated 4 years ago
- ☆18Feb 26, 2026Updated 7 months ago
- Compute neighbor lists for atomistic systems☆86Sep 10, 2026Updated 2 weeks ago
- jax library for E3 Equivariant Neural Networks☆234Apr 1, 2026Updated 5 months ago
- STable AutoCorrelation Integral Estimator for time-correlated data☆20Updated this week
- [ICLR'24] Symphony: Symmetry-Equivariant Point-Centered Spherical Harmonics for Molecule Generation☆30Feb 24, 2025Updated last year
- ☆12Sep 16, 2024Updated 2 years ago
- End-to-end encrypted cloud storage - Proton Drive • AdSpecial offer: 40% Off Yearly / 80% Off First Month. Protect your most important files, photos, and documents from prying eyes.
- OpenEquivariance: a fast, open-source GPU JIT kernel generator for the Clebsch-Gordon Tensor Product.☆169Updated this week
- Pure C implementation of e3nn☆26Mar 17, 2025Updated last year
- ☆17Apr 22, 2025Updated last year
- Auto-differentiated descriptors using Enzyme☆12Apr 2, 2025Updated last year
- Building Blocks for Equivariant Neural Networks in e3nn and PyTorch 2.0☆22Nov 16, 2025Updated 10 months ago
- An overview of literature that discusses the use of machine learning for atomistic simulations☆44Apr 11, 2023Updated 3 years ago
- Force-field-enhanced Neural Networks optimized library☆90Jun 29, 2026Updated 2 months ago
- Training Neural Network potentials through customizable routines in JAX.☆73Updated this week
- LES extension package for NequIP☆21Aug 14, 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.
- Implementation of various equivariant models in JAX☆18Apr 12, 2024Updated 2 years ago
- E3x is a JAX library for constructing efficient E(3)-equivariant deep learning architectures built on top of Flax.☆126Sep 9, 2026Updated 2 weeks ago
- CUDA implementations of MACE models☆22Aug 19, 2025Updated last year
- [ICLR 2024 Spotlight] Official Implementation of "Enabling Efficient Equivariant Operations in the Fourier Basis via Gaunt Tensor Product…☆74Nov 2, 2024Updated last year
- Self-describing sparse tensor data format for atomistic machine learning and beyond☆108Sep 16, 2026Updated last week
- Pseudopotential converter from upf to psp8☆11Jan 25, 2023Updated 3 years ago
- Particle-mesh based calculations of long-range interactions in JAX☆31Updated this week
- cuEquivariance is a math library that is a collective of low-level primitives and tensor ops to accelerate widely-used models, like DiffD…☆437Updated this week
- Tensor Atomic/Edge Cluster Expansion☆69Updated this week
- GPU virtual machines on DigitalOcean Gradient AI • AdGet to production fast with high-performance AMD and NVIDIA GPUs you can spin up in seconds. The definition of operational simplicity.
- MESS: Modern Electronic Structure Simulations☆44May 9, 2026Updated 4 months ago
- ☆19Mar 14, 2023Updated 3 years ago
- e3nn tutorial for Materials Research Society Fall Meeting 2021☆14Nov 29, 2021Updated 4 years ago
- Allegro-pol extends the Allegro architecture to model the electric response of materials☆41May 30, 2026Updated 3 months ago
- PaiNN in jax☆11Jan 14, 2025Updated last year
- Jax / Haiku implementation of DimeNet++.☆18Mar 31, 2022Updated 4 years ago
- E(n) Equivariant GNN in jax☆14Aug 31, 2023Updated 3 years ago