MLMI2-CSSI / foundryLinks
Simplifying the discovery and usage of machine-learning ready datasets in materials science and chemistry
☆82Updated 2 months ago
Alternatives and similar repositories for foundry
Users that are interested in foundry are comparing it to the libraries listed below
Sorting:
- Course materials for "Applied AI for Materials Science and Engineering"☆65Updated 3 years ago
- jobflow is a library for writing computational workflows.☆104Updated this week
- pyiron_atomistics - an integrated development environment (IDE) for atomistic simulation in computational materials science.☆45Updated this week
- A one-stop-shop for handling data in computational spectroscopy☆16Updated 5 months ago
- A collection of scikit-learn compatible utilities that implement methods born out of the materials science and chemistry communities☆86Updated 3 weeks ago
- Agent-based sequential learning software for materials discovery☆63Updated last year
- ☆11Updated last year
- ☆43Updated 4 months ago
- Self-describing sparse tensor data format for atomistic machine learning and beyond☆79Updated last week
- ☆19Updated last year
- A materials discovery algorithm geared towards exploring high-performance candidates in new chemical spaces.☆44Updated 11 months ago
- python library for atomistic machine learning☆84Updated last month
- ☆41Updated last year
- polygon (ring network) discovery from XYZ files☆10Updated 9 years ago
- Encode/decode a crystal structure to/from a grayscale PNG image for direct use with image-based machine learning models such as Palette.☆37Updated last year
- A Python package for estimating diffusion properties from molecular dynamics simulations.☆72Updated last week
- A Python package for adding uncertainties to neural network models of chemical systems.☆26Updated 3 years ago
- A many-body extension of the FLARE code.☆36Updated 3 years ago
- ☆40Updated last week
- Data Science for Materials Science☆64Updated this week
- A quick tutorial for modern materials science, should the reader be not familiar with it and just wishing to crack the data☆16Updated 10 months ago
- The Wren sits on its Roost in the Aviary.☆58Updated last month
- Specification of a common REST API for access to materials databases☆92Updated last month
- AlabOS: Managing the workflows in the Autonomous lab☆44Updated last week
- Python library written in C++ for calculation of local atomic structural environment☆64Updated 11 months ago
- ☆34Updated 9 months ago
- A scalable and versatile library to generate representations for atomic-scale learning☆82Updated last year
- Deep learning framework for atomistic image data☆34Updated last month
- The materials for the Fall ML in Materials course at the UTK MSE☆85Updated last year
- ☆26Updated 9 months ago