RosettaScripts and commandline instructions
#any improtant residues
Command line options (wrapped in “flags” file)
-use_input_sc
-extrachi_cutoff 5
-ignore_unrecognized_res
-use_occurrence_data
-chemical:exclude_patches LowerDNA UpperDNA Cterm_amidation SpecialRotamer VirtualBB ShoveBB VirtualDNAPhosphate VirtualNTerm CTermConnect sc_orbitals pro_hydroxylated_case1 pro_hydroxylated_case2 ser_phosphorylated thr_phosphorylated tyr_phosphorylated tyr_sulfated lys_dimethylated lys_monomethylated lys_trimethylated lys_acetylated glu_carboxylated cys_acetylated tyr_diiodinated N_acetylated C_methylamidated MethylatedProteinCterm
-linmem_ig 10
-ignore_zero_occupancy false
-out:path:pdb pdb/
-out:path:score score/
-mute all
-overwrite
-parser:script_vars res_to_fix=-1 # residues prevented from repacking. use with the script_vars pdb_reference
-database Rosetta/main/database/
Command line execution
rosetta_scripts.default.linuxgccrelease @flags -s -parser:protocol