SergeiVKalinin / MSE_Fall2024Links
☆64Updated last year
Alternatives and similar repositories for MSE_Fall2024
Users that are interested in MSE_Fall2024 are comparing it to the libraries listed below
Sorting:
- The materials for the Fall ML in Materials course at the UTK MSE☆88Updated 2 years ago
- The materials for the Spring Mathematics in Materials course at the UTK MSE☆50Updated last year
- ☆20Updated last year
- Honegumi (骨組み) is an interactive "skeleton code" generator for API tutorials focusing on optimization packages.☆65Updated last month
- ☆43Updated last year
- Application of Large Language Models (LLM) for computational materials science - visit jan-janssen.com/LangSim☆79Updated 5 months ago
- ☆34Updated last year
- A unified platform for fine-tuning atomistic foundation models in chemistry and materials science☆70Updated 3 weeks ago
- Deep learning framework for atomistic image data☆34Updated 4 months ago
- MSE5540/6640 Materials Informatics course at the University of Utah. Learn how data science tools are revolutionizing materials science!☆198Updated 3 weeks ago
- This repository is no longer maintained. For the latest updates and continued development, please visit: https://github.com/atomgptlab/ja…☆93Updated 5 months ago
- ☆36Updated 2 weeks ago
- AlabOS: Managing the workflows in the Autonomous lab☆46Updated last week
- Tutorials for using the pymatgen library☆62Updated 7 months ago
- A materials discovery algorithm geared towards exploring high-performance candidates in new chemical spaces.☆45Updated last year
- Strategies for the Construction of Neural-Network Based Machine-Learning Potentials (MLPs)☆29Updated 4 years ago
- The architector python package - for 3D metal complex design. C22085☆75Updated 3 weeks ago
- Collection of tutorials to use the MACE machine learning force field.☆50Updated last year
- Microcourses hosted by the Acceleration Consortium for self-driving lab topics.☆33Updated last month
- A collection of scikit-learn compatible utilities that implement methods born out of the materials science and chemistry communities☆89Updated last week
- A template for Python packages. Developed by the @quantum-accelerators☆64Updated 2 weeks ago
- Encode/decode a crystal structure to/from a grayscale PNG image for direct use with image-based machine learning models such as Palette.☆38Updated 2 years ago
- train and use graph-based ML models of potential energy surfaces☆117Updated last week
- A Python package for estimating diffusion properties from molecular dynamics simulations.☆76Updated this week
- ☆22Updated 2 years ago
- Data Science for Materials Science☆66Updated last week
- Code for automated fitting of machine learned interatomic potentials.☆133Updated 2 weeks ago
- The course materials for "Machine Learning in Chemistry 101"☆84Updated 5 years ago
- Agent-based sequential learning software for materials discovery☆63Updated last year
- Course materials for "Applied AI for Materials Science and Engineering"☆69Updated 3 years ago