sgbaird / honegumi
Honegumi (骨組み) is an interactive "skeleton code" generator for API tutorials focusing on optimization packages.
☆42Updated 3 weeks ago
Alternatives and similar repositories for honegumi:
Users that are interested in honegumi are comparing it to the libraries listed below
- A materials discovery algorithm geared towards exploring high-performance candidates in new chemical spaces.☆39Updated 6 months ago
- Generative materials benchmarking metrics, inspired by guacamol and CDVAE.☆35Updated 8 months ago
- Codebase to drive the Perovskite Automated Spin Coat Assembly Line (PASCAL) in the Fenning research group.☆15Updated this week
- Microcourses hosted by the Acceleration Consortium for self-driving lab topics.☆28Updated last month
- hierachical automation of the natural sciences☆20Updated last week
- ☆18Updated 6 months ago
- ☆11Updated last month
- Software for evaluating pareto-optimal synthesis pathways☆25Updated 8 months ago
- Encode/decode a crystal structure to/from a grayscale PNG image for direct use with image-based machine learning models such as Palette.☆36Updated last year
- Benchmarking☆26Updated 3 years ago
- AlabOS: Managing the workflows in the Autonomous lab☆38Updated 3 months ago
- ☆53Updated last year
- Application of Large Language Models (LLM) for computational materials science - visit jan-janssen.com/LangSim☆55Updated 3 months ago
- train and use graph-based ML models of potential energy surfaces☆69Updated this week
- ☆31Updated 4 years ago
- The Wren sits on its Roost in the Aviary.☆51Updated 2 weeks ago
- ☆10Updated last month
- ☆37Updated 10 months ago
- Zooming Memory Based Initialization (ZoMBI) algorithm for discovery of optima within challenging needle-in-a-haystack (extreme data imbal…☆16Updated last year
- Quick Uncertainty and Entropy via STructural Similarity☆33Updated last month
- ☆31Updated 4 months ago
- Machine-Learned Interatomic Potential eXploration (mlipx) is designed at BASF for evaluating machine-learned interatomic potentials (MLIP…☆70Updated this week
- ZeoSyn: A Comprehensive Zeolite Synthesis Dataset Enabling Machine-learning Rationalization of Hydrothermal Parameters (ACS Central Scien…☆23Updated 4 months ago
- Active Learning for Machine Learning Potentials☆49Updated 9 months ago
- The summer training course on the Bayesian Optimization☆27Updated last year
- rule-based virtual polymer library generator☆31Updated last month
- Fair and transparent benchmark of machine-learned interatomic potentials (MLIPs), beyond basic error metrics☆56Updated last week
- An ecosystem for digital reticular chemistry☆44Updated 5 months ago
- A public repository collecting links to state of the art QA and evaluation sets for various ML and LLM applications☆89Updated 7 months ago
- A text-guided diffusion model for crystal structure generation☆35Updated this week