Ml4chem
ML4Chem: Machine Learning for Chemistry and Materials
| Project Name | Stars | Downloads | Repos Using This | Packages Using This | Most Recent Commit | Total Releases | Latest Release | Open Issues | License | Language |
|---|---|---|---|---|---|---|---|---|---|---|
| Awesome Python Chemistry | 971 | 4 months ago | 2 | other | ||||||
| A curated list of Python packages related to chemistry | ||||||||||
| Awesome Materials Informatics | 310 | 6 months ago | ||||||||
| Curated list of known efforts in materials informatics = modern materials science | ||||||||||
| Mlearn | 83 | 2 years ago | 1 | bsd-3-clause | Python | |||||
| Benchmark Suite for Machine Learning Interatomic Potentials for Materials | ||||||||||
| Geom3d | 75 | 4 months ago | 1 | August 09, 2023 | 3 | mit | Python | |||
| Geom3D: Geometric Modeling on 3D Structures, NeurIPS 2023 | ||||||||||
| Foundry | 71 |  | 2 | 3 months ago | 29 | November 13, 2023 | 92 | mit | Python | |
| Simplifying the discovery and usage of machine-learning ready datasets in materials science and chemistry | ||||||||||
| Ml4chem | 64 | 3 years ago | 10 | March 07, 2020 | 8 | other | Python | |||
| ML4Chem: Machine Learning for Chemistry and Materials | ||||||||||
| Elemnet | 60 | 2 years ago | 2 | other | Jupyter Notebook | |||||
| Deep Learning the Chemistry of Materials From Only Elemental Composition for Enhancing Materials Property Prediction | ||||||||||
| Qmflows | 44 |  | 4 | 5 | 7 months ago | 9 | October 06, 2023 | 1 | other | Python |
| This library tackles the construction and efficient execution of computational chemistry workflows | ||||||||||
| Thermoparser | 31 | 7 months ago | agpl-3.0 | Python | ||||||
| A tool for streamlining data analysis and visualisation for thermoelectrics and charge carrier transport in computational materials science. | ||||||||||
| Labgraph | 18 | 8 months ago | Python | |||||||
| A graph database tool for experimental data in materials science and chemistry. | ||||||||||
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Python
Deep Learning
Machine Learning
Kernel
Material
Physics
Chemistry