Projects | Open Source Science

Projects

Updated 6 months ago

gnina-torch • Rank 5.2 • Science 77%

🔥 PyTorch implementation of GNINA scoring function for molecular docking

deep-learning docking drug-discovery gnina pytorch pytorch-ignite scoring-functions

Updated 6 months ago

https://github.com/compomics/spectrum_similarity • Science 23%

Scoring functions to compare MS/MS spectra

bioinformatics proteomics scoring-functions spectrum-similarity