diff --git a/projects/novelfams/translate2modelcif.py b/projects/novelfams/translate2modelcif.py index 45849872d5346d2ae834021ef0ba53e3ae98e8e1..add84bb08a101faee2a1b4c4b9e4ea0edf74adca 100644 --- a/projects/novelfams/translate2modelcif.py +++ b/projects/novelfams/translate2modelcif.py @@ -139,13 +139,6 @@ class _LocalPairwisePAE( software = None -class _NmpfamsdbTrgRef(modelcif.reference.TargetReference): - """NMPFamsDB as target reference.""" - - name = "Other" - other_details = "NMPFamsDB" - - class _LPeptideAlphabetWithX(ihm.LPeptideAlphabet): """Have the default amino acid alphabet plus 'X' for unknown residues.""" @@ -242,7 +235,7 @@ def _get_pdb_files(model_dir): def _get_title(fam_name): """Get a title for this modelling experiment.""" - return f"Model for NMPFamsDB Family {fam_name}" + return f"Model for {fam_name}" def _get_model_details(fam_name): @@ -713,9 +706,10 @@ def _translate2modelcif(f_name, af2_lst, opts): else: cifext = "cif" mdl_path = os.path.join(opts.out_dir, f"{f_name}.{cifext}") - if os.path.exists(mdl_path): - print(f" {f_name} already done") - return + # ToDo: re-enable for final version + #if os.path.exists(mdl_path): + # print(f" {f_name} already done") + # return # get model details mdl_details = _get_model_details(