GitHub - lovingstudy/Molecule-process: Some scripts about discovery of novel active molecules

Name		Name	Last commit message	Last commit date
Latest commit History 6 Commits
Convert.py		Convert.py
alignPM.py		alignPM.py
basic_functions_targetfish.py		basic_functions_targetfish.py
cal_RMSD.py		cal_RMSD.py
chimera_mol2_conv.py		chimera_mol2_conv.py
convert_pdb_pybel.py		convert_pdb_pybel.py
dockingEnrichAnalyser.py		dockingEnrichAnalyser.py
filters_on_molGen.py		filters_on_molGen.py
getStrucFromChemicalbook.py		getStrucFromChemicalbook.py
point2Plane.py		point2Plane.py
proteinPrepBatch.py		proteinPrepBatch.py
sdf2sheet.py		sdf2sheet.py
smarts_filter.py		smarts_filter.py
table_sdf_binder.py		table_sdf_binder.py
vinaOut2sdf.py		vinaOut2sdf.py
vina_scr.py		vina_scr.py
vinarun.py		vinarun.py