Guacamol
| Project Name | Stars | Downloads | Repos Using This | Packages Using This | Most Recent Commit | Total Releases | Latest Release | Open Issues | License | Language |
|---|---|---|---|---|---|---|---|---|---|---|
| Tdc | 889 |  | 4 | 4 months ago | 32 | January 27, 2023 | 34 | mit | Jupyter Notebook | |
| Therapeutics Data Commons: Artificial Intelligence Foundation for Therapeutic Science | ||||||||||
| Guacamol | 265 | | 1 | 2 years ago | 7 | September 19, 2023 | 6 | mit | Python | |
| Benchmarks for generative chemistry | ||||||||||
| Summit | 92 | 9 months ago | 14 | April 25, 2022 | 6 | mit | Jupyter Notebook | |||
| Optimising chemical reactions using machine learning | ||||||||||
| Matbench | 88 |  | 2 | 3 months ago | 5 | July 27, 2022 | 37 | mit | Python | |
| Matbench: Benchmarks for materials science property prediction | ||||||||||
| Gpusimilarity | 85 | 3 months ago | 7 | bsd-3-clause | C++ | |||||
| A Cuda/Thrust implementation of fingerprint similarity searching | ||||||||||
| Fep Benchmark | 63 | a year ago | mit | |||||||
| Benchmark set for relative free energy calculations. | ||||||||||
| Gqcp | 29 | 5 months ago | 61 | lgpl-3.0 | Jupyter Notebook | |||||
| The Ghent Quantum Chemistry Package for electronic structure calculations | ||||||||||
| Benchmarks | 10 | 11 years ago | Shell | |||||||
| HPC Benchmarks for most popular applications in Chemistry, Physics, Biology, and some other related subjects | ||||||||||
| Smpl | 10 | a year ago | 1 | mit | Jupyter Notebook | |||||
| Hgbenchmark | 5 | 6 years ago | IDL | |||||||
| GEOS-Chem mercury benchmark | ||||||||||
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