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Commits on Apr 1, 2020

• Rename PED.shd to Descriptors/PED.shd

  tonibois

  authored
  bc14cd4

• Update PED_batch.py

  tonibois

  authored
  ab6f77c

• Delete LICENSE

  tonibois

  authored
  469be59

• Update PED_VS.py

  tonibois

  authored
  80298bf

• Update MOL2_TO_PED.f95

  tonibois

  authored
  0f61b7a

• Rename molecules/favipiravir.sdf to molecules/SDF/favipiravir.sdf

  tonibois

  authored
  115e2bf

• Update MOL2_TO_PED.py

  tonibois

  authored
  f48e7d2

Commits on Mar 31, 2020

• Update MOL2_TO_PED.f95

  tonibois

  authored
  e952f70

• Update MOL2_TO_PED.f95

  tonibois

  authored
  cef5b35

• Add files via upload

  tonibois

  authored
  dbcb4e3

Commits on Mar 20, 2020

• Add files via upload

  tonibois

  authored
  66b73a9

• Add files via upload

  tonibois

  authored
  86f8c4a

• Add files via upload

  tonibois

  authored
  4c7db70

• Add files via upload

  tonibois

  authored
  4a41b85

• Add files via upload

  tonibois

  authored
  683f920

• Rename remdes.svg to 2D_figures/remdes.svg

  tonibois

  authored
  e75ade4

• Update PED_batch.py

  tonibois

  authored
  fd867c6

• Update PED_batch.py

  tonibois

  authored
  8e6aeb7

• Rename REMDESIVIR.mol.mol2 to molecules/REMDESIVIR.mol.mol2

  tonibois

  authored
  47e0f33

• Rename remdesivprop.smi to molecules/smiles/remdesivprop.smi

  tonibois

  authored
  a179cfc

• Rename favipiravir.sdf to molecules/favipiravir.sdf

  tonibois

  authored
  187b859

• Rename REMDESIVIR.smi to molecules/smiles/REMDESIVIR.smi

  tonibois

  authored
  16fd528

• Rename REMDESIVIR.mol to molecules/REMDESIVIR.mol

  tonibois

  authored
  eb50b45

• Rename LOPINAVIR.mol.mol2 to molecules/LOPINAVIR.mol.mol2

  tonibois

  authored
  3055a57

• Rename LOPINAVIR.mol to molecules/LOPINAVIR.mol

  tonibois

  authored
  71fe8bf

• Rename Hydroxychloroquine.mol.mol2 to molecules/Hydroxychloroquine.mol.mol2

  tonibois

  authored
  2968dc9

• Rename Hydroxychloroquine.mol to molecules/Hydroxychloroquine.mol

  tonibois

  authored
  c588286

• Rename Hydroxcl.smi to molecules/smiles/Hydroxcl.smi

  tonibois

  authored
  ec27fa7

• Rename FINGOLIMOD.mol.mol2 to molecules/FINGOLIMOD.mol.mol2

  tonibois

  authored
  73858ac

• Rename FINGOLIMOD.mol to molecules/FINGOLIMOD.mol

  tonibois

  authored
  e555c7a

• Rename DARUNAVIR.mol.mol2 to molecules/DARUNAVIR.mol.mol2

  tonibois

  authored
  d46e04e

• Rename DARUNAVIR.mol to molecules/DARUNAVIR.mol

  tonibois

  authored
  208ec3f

• Rename CLOROQUINA.mol.mol2 to molecules/CLOROQUINA.mol.mol2

  tonibois

  authored
  ea49d70

• Rename CLOROQUINA.mol to molecules/CLOROQUINA.mol

  tonibois

  authored
  b820efd

• Add files via upload

  tonibois

  authored
  63ac919

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