extract-ligand

There are 0 repository under extract-ligand topic.

• lucagl / MOAD_ligandFinder

  A script able to extract ligands from pdb structure(s) and remove them from the original structure. The ligands are identified according to the *valid* ligands found in the binding MOAD database. The ligand can be extracted as a pdb or as a xyz (coordinate) file. Other options such as converting the queried pdb to pqr are available .

  pdb-filesligandspqr-filesbinding-moadextract-ligandremove-ligands
  Language:Python 13