A modular framework for neural networks with Euclidean symmetry
☆11Jul 1, 2024Updated last year
Alternatives and similar repositories for e3nn
Users that are interested in e3nn are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Generate 3D transition state geometries with GNNs☆14Oct 13, 2020Updated 5 years ago
- ☆20Jun 21, 2022Updated 3 years ago
- ☆12Aug 15, 2023Updated 2 years ago
- Code Repository for "Direct prediction of phonon density of states with Euclidean neural network"☆29May 19, 2022Updated 3 years ago
- ☆166Mar 14, 2024Updated 2 years ago
- 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.
- ☆170Feb 28, 2022Updated 4 years ago
- Primer of crystal symmetry and space group☆17Jan 7, 2026Updated 3 months ago
- Reaction Data and Molecular Conformers (RDMC) is a package dealing with reactions, molecules, conformers, majorly in 3D.☆30Apr 9, 2025Updated last year
- A wrapper to run xtb inside Gaussian.☆27Aug 18, 2020Updated 5 years ago
- This is an updated version of the MolecularTransformer of Schwaller et. al.☆14Jan 17, 2022Updated 4 years ago
- Tutorial exercises for the OPTIMADE API☆17Sep 27, 2023Updated 2 years ago
- repository and website for tutorials on 3d Euclidean equivariant neural networks☆79Feb 24, 2021Updated 5 years ago
- An Autodesk Maya plugin for modelling DNA based structures☆18Jun 11, 2014Updated 11 years ago
- an ultra-minimal productivity system☆19Jul 6, 2023Updated 2 years ago
- 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.
- Multiplexed data-independent acquisition (plexDIA) for increasing proteomics throughput. The code is distributed by an MIT license.☆11Mar 17, 2025Updated last year
- Repo for a DOE HPC workflow training event☆14Apr 28, 2023Updated 2 years ago
- SignNet and BasisNet☆102Jul 25, 2023Updated 2 years ago
- scalable data movement in Exascale Supercomputers☆19Mar 30, 2026Updated 2 weeks ago
- Models the Reactome knowledgebase into a interconnected graph☆20Mar 30, 2026Updated 2 weeks ago
- Code for the ICML 2019 paper: Distribution Calibration for Regression☆22Aug 8, 2023Updated 2 years ago
- Implementation of Lie Transformer, Equivariant Self-Attention, in Pytorch☆97Feb 19, 2021Updated 5 years ago
- Source code accompanying the NeurIPS 2022 paper "Learning Partial Equivariances From Data"☆10Nov 18, 2022Updated 3 years ago
- DiAMoNDBack: Diffusion-denoising Autoregressive Model for Non-Deterministic Backmapping of Cα Protein Traces☆19May 7, 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.
- Implementation of Torsional Diffusion for Molecular Conformer Generation (NeurIPS 2022)☆281Feb 10, 2024Updated 2 years ago
- ☆13Mar 1, 2024Updated 2 years ago
- ☆11Aug 27, 2021Updated 4 years ago
- Collection of small examples for running on ALCF resources☆21Updated this week
- An exploration of the state of the art in the application of data science to quantum chemistry.☆13Dec 30, 2025Updated 3 months ago
- A Benchmarking Framework for Crystal GNNs☆21Jan 3, 2024Updated 2 years ago
- Generate symmetrized force constants☆27Apr 6, 2026Updated last week
- CookieCutter template for getting started with Flyte python projects☆20Apr 4, 2025Updated last year
- Machine Learning classifier to predict MBTI personality type of an individual using their tweets 🙍☆17Apr 6, 2018Updated 8 years 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.
- Synthesis generative model☆47Apr 24, 2025Updated 11 months ago
- DistilProtBert implementation, a distilled version of ProtBert model.☆15Sep 21, 2022Updated 3 years ago
- Explainable Multilayer Graph Neural Network for Cancer Gene Prediction☆21Nov 3, 2023Updated 2 years ago
- Structured Multi-task Learning for Molecular Property Prediction, AISTATS'22 (https://proceedings.mlr.press/v151/liu22e.html)☆14Jul 6, 2022Updated 3 years ago
- ☆27Mar 3, 2024Updated 2 years ago
- ☆11Oct 25, 2024Updated last year
- Molecular Processing Made Easy.☆533Jun 10, 2024Updated last year