CitrineInformatics / citrine-python
☆21Updated this week
Related projects ⓘ
Alternatives and complementary repositories for citrine-python
- Python binding for Citrine's GEMD data model☆12Updated 3 weeks ago
- Codebase to drive the Perovskite Automated Spin Coat Assembly Line (PASCAL) in the Fenning research group.☆15Updated 3 weeks ago
- Code to help you get started using machine learning in materials science☆15Updated 5 years ago
- A materials discovery algorithm geared towards exploring high-performance candidates in new chemical spaces.☆39Updated 2 months ago
- Training materials☆22Updated 4 years ago
- ☆14Updated 2 years ago
- 3-D Inorganic Crystal Structure Generation and Property Prediction via Representation Learning (JCIM 2020)☆37Updated last year
- Reference implementation in python for Citrination api☆14Updated 3 years ago
- hierachical automation of the natural sciences☆20Updated 10 months ago
- Agent-based sequential learning software for materials discovery☆60Updated 9 months ago
- The Element Movers Distance for chemical composition similarity☆31Updated 2 weeks ago
- Python toolkit for working with PIFs☆8Updated 2 years ago
- ☆16Updated 11 months ago
- ☆31Updated 4 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.☆35Updated last year
- The Wren sits on its Roost in the Aviary.☆48Updated this week
- Generative deep learning model for inorganic materials☆15Updated last year
- Predict materials properties using only the composition information!☆92Updated last year
- ML4Chem: Machine Learning for Chemistry and Materials☆95Updated last year
- Expanded dataset of mechanical properties and observed phases of multi-principal element alloys☆31Updated 2 years ago
- ☆23Updated 2 years ago
- An ecosystem for digital reticular chemistry☆43Updated 2 months ago
- AlabOS: Managing the workflows in the Autonomous lab☆34Updated 3 weeks ago
- ☆15Updated 2 years ago
- Representation Learning from Stoichiometry☆53Updated last year
- Multiobjective active learning with tunable accuracy/efficiency tradeoff and clear stopping criterion.☆38Updated last month
- Python code for the paper Bayesian Optimization of Nanoporous Materials.☆21Updated last year
- Machine learning model for crystal lattice constant prediction☆10Updated 3 years ago
- A Python package for adding uncertainties to neural network models of chemical systems.☆22Updated 2 years ago
- Crystal Edge Graph Attention Neural Network☆20Updated 4 months ago