Deep Learning the Chemistry of Materials From Only Elemental Composition for Enhancing Materials Property Prediction
☆104Jan 13, 2026Updated 3 months ago
Alternatives and similar repositories for ElemNet
Users that are interested in ElemNet are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Predict materials properties using only the composition information!☆125Apr 23, 2023Updated 3 years ago
- ☆26Nov 12, 2023Updated 2 years ago
- Crystal Graph Neural Networks☆109Apr 20, 2024Updated 2 years ago
- MODNet: a framework for machine learning materials properties☆107May 2, 2025Updated last year
- Learning to Discover Crystallographic Structures with Generative Adversarial Networks☆40Nov 21, 2019Updated 6 years ago
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- Representation Learning from Stoichiometry☆61Dec 12, 2022Updated 3 years ago
- Graph Networks as a Universal Machine Learning Framework for Molecules and Crystals☆555Apr 27, 2023Updated 3 years ago
- A suite of computational materials science tools.☆144Apr 3, 2024Updated 2 years ago
- Veidt is a deep learning library for materials science.☆18May 5, 2020Updated 6 years ago
- An automatic engine for predicting materials properties.☆169Nov 12, 2023Updated 2 years ago
- A Python package for adding uncertainties to neural network models of chemical systems.☆27Jul 5, 2022Updated 3 years ago
- Pytorch Repository for our work: Graph convolutional neural networks with global attention for improved materials property prediction☆86Dec 17, 2024Updated last year
- Matbench: Benchmarks for materials science property prediction☆195Aug 20, 2024Updated last year
- ☆12Jan 16, 2024Updated 2 years ago
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- ☆35Feb 17, 2022Updated 4 years ago
- Data mining for materials science☆584Apr 27, 2026Updated last week
- Predict materials properties using only the composition information!☆17Jun 4, 2025Updated 11 months ago
- Python API wrapping the AFLUX API language for AFLOW library.☆29May 6, 2021Updated 4 years ago
- Curated list of known efforts in collecting and/or curating of chemical/materials data☆23Dec 8, 2020Updated 5 years ago
- Things that you should (and should not) do in your Materials Informatics research.☆202Nov 17, 2023Updated 2 years ago
- Distributed representations of atoms, inspired by the Skip-gram model☆28Jul 16, 2023Updated 2 years ago
- A program to automatically generate volcano plots for catalysis.☆15Dec 6, 2024Updated last year
- Supporting materials for "An Adaptive Machine Learning Strategy for Accelerating Discovery of Perovskite Electrocatalysts".☆29Nov 13, 2019Updated 6 years ago
- Wordpress hosting with auto-scaling - Free Trial Offer • AdFully Managed hosting for WordPress and WooCommerce businesses that need reliable, auto-scalable performance. Cloudways SafeUpdates now available.
- The Wren sits on its Roost in the Aviary.☆63Apr 12, 2026Updated 3 weeks ago
- ☆12Feb 14, 2024Updated 2 years ago
- Benchmark AFLOW Data Sets for Machine Learning doi.org/10.1007/s40192-020-00174-4☆11Aug 29, 2020Updated 5 years ago
- Data-driven risk-conscious thermoelectric materials discovery☆17Nov 12, 2025Updated 5 months ago
- Simplifying the discovery and usage of machine-learning ready datasets in materials science and chemistry☆85Jan 22, 2026Updated 3 months ago
- Specification of a common REST API for access to materials databases☆105Apr 24, 2026Updated last week
- image-based generative model for inverse design of solid state materials☆44Feb 18, 2022Updated 4 years ago
- This repo implements a web application utilizing a deep neural network to predict the formation energies and stability of garnet crystals…☆33May 1, 2023Updated 3 years ago
- Repository for links to software packages and databases used in deep-learning applications for materials science☆151May 2, 2025Updated last year
- 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.
- The Element Movers Distance for chemical composition similarity☆37Mar 21, 2025Updated last year
- ML4Chem: Machine Learning for Chemistry and Materials☆101Dec 9, 2024Updated last year
- NeurIPS 2018 MLMM Workshop: Integrating Crystal Graph Convolutional Neural Network with Multitask Learning for Material Property Predicti…☆70May 3, 2024Updated 2 years ago
- Chemically Directed Atom Swap Hopping -- Crystal structure prediction by swapping atoms in unfavourable chemical environments☆22Apr 19, 2023Updated 3 years ago
- ☆16Aug 5, 2022Updated 3 years ago
- Scalable graph neural networks for materials property prediction☆65Feb 2, 2026Updated 3 months ago
- Python package to aid materials design and informatics☆133Apr 21, 2026Updated last week