Namd Fep
Cloud GPU supported NAMD3-based binding free energy difference between two small molecules against the same protein target. This is probably one of the fastest FEP simulation with FREE GPU hardwares that the genearl public could have access to
| Project Name | Stars | Downloads | Repos Using This | Packages Using This | Most Recent Commit | Total Releases | Latest Release | Open Issues | License | Language |
|---|---|---|---|---|---|---|---|---|---|---|
| Tinker9 | 44 | 8 months ago | 16 | other | C++ | |||||
| Tinker9: Next Generation of Tinker with GPU Support | ||||||||||
| Namd Fep | 14 | 2 years ago | mit | Jupyter Notebook | ||||||
| Cloud GPU supported NAMD3-based binding free energy difference between two small molecules against the same protein target. This is probably one of the fastest FEP simulation with FREE GPU hardwares that the genearl public could have access to | ||||||||||
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