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.