GitHub - tonibois/PED_MolecularDescriptors: Analysis of COVID19 Candidates using molecular descriptors from mol2 files

tonibois / PED_MolecularDescriptors Public

Analysis of COVID19 Candidates using molecular descriptors from mol2 files

www.nature.com/articles/srep43738

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Name		Name	Last commit message	Last commit date
Latest commit History 38 Commits
2D_figures		2D_figures
Descriptors		Descriptors
molecules		molecules
MOL2_TO_PED.f95		MOL2_TO_PED.f95
MOL2_TO_PED.py		MOL2_TO_PED.py
PED_VS.py		PED_VS.py
PED_batch.py		PED_batch.py
What do we kwnow about potenial drugs of COVID-19.ipynb		What do we kwnow about potenial drugs of COVID-19.ipynb
collagemol.png		collagemol.png
remdes.mol2		remdes.mol2