Prints all dihedral angles of the molecule. The minimal configuration file for Dihedrals:


It can be run from the command line:

FoldX --command=Dihedrals --pdb=DH.pdb

FoldX uses output-file as a tag to label different outputs from different commands in batch runs. After running Dihedrals you'll get one file to look at. Given output-file="TAG" the output file is:

  • DH_TAG.fxout -> Residue dihedrals

If you don't set output-file, TAG will be the pdbId of the first pdb on the batch.