Commits

Branch selector

 main

User selector

All users

Datepicker

All time

Commit History

Commits on Oct 10, 2024

• a cool plugin of fpocket added to the collection. Now pockts can be computed directly in pymol

  AngelRuizMoreno

  committed
  2217a58

  Copy full SHA for 2217a58

Commits on Oct 9, 2024

• Kcombu package for comilation and installation conda available

  AngelRuizMoreno

  committed
  2191f6f

  Copy full SHA for 2191f6f

• plugins added to chem tools

  AngelRuizMoreno

  committed
  c889f37

  Copy full SHA for c889f37

• Chem Tools pymol plugins initialized and tested

  AngelRuizMoreno

  committed
  0332adb

  Copy full SHA for 0332adb

Commits on Oct 8, 2024

• Improved scripts to display USAGE in the pymol menu

  AngelRuizMoreno

  committed
  7c646e1

  Copy full SHA for 7c646e1

Commits on Oct 7, 2024

• my attempts to run smina from pymol will go here... wish me luck!!

  AngelRuizMoreno

  committed
  32afae1

  Copy full SHA for 32afae1

• An amazing pllug in from MengwuXiao to get docking boxes in PyMol

  AngelRuizMoreno

  committed
  810c56c

  Copy full SHA for 810c56c

• handy script to compute molecular interactions using plip and save the results to a file (dataframe)

  Show description for 0e50f3c
  AngelRuizMoreno

  committed
  0e50f3c

  Copy full SHA for 0e50f3c

• script to generate spheres (pharmacophoric points), needs optimization

  AngelRuizMoreno

  committed
  55e9d06

  Copy full SHA for 55e9d06

• script initialized, not yet optimized to show full residues

  AngelRuizMoreno

  committed
  6b750cb

  Copy full SHA for 6b750cb

• simple improvements done to script

  AngelRuizMoreno

  committed
  b3d24d5

  Copy full SHA for b3d24d5

• alig_ligand scripts for pymol added to the repo

  AngelRuizMoreno

  committed
  0f7f57c

  Copy full SHA for 0f7f57c

• Create .gitignore

  AngelRuizMoreno

  authored
  03fd8b5

  Copy full SHA for 03fd8b5

• Initial commit

  AngelRuizMoreno

  authored
  5aa9e0c

  Copy full SHA for 5aa9e0c