GitHub - Justin-Bergmann/scripts1: selection of scripts to run comqum-x/u and ad hydrogen atoms

Selection of scripts to runn comqum-x/u and add hydrogens to proteins

Name		Name	Last commit message	Last commit date
Latest commit History 1 Commit
README.md		README.md
d_orientation.py		d_orientation.py
extract.py		extract.py
extract_final_coord.py		extract_final_coord.py
find_lost_atoms.py		find_lost_atoms.py
gen_syst1.py		gen_syst1.py
int_ele.sh		int_ele.sh
pdb_to_xyz.py		pdb_to_xyz.py
prep_vis_4tkv.sh		prep_vis_4tkv.sh
prep_vis_5n6y.sh		prep_vis_5n6y.sh
prep_vis_6ug0.sh		prep_vis_6ug0.sh
restart_comqum_pdb.py		restart_comqum_pdb.py
run_al.sh		run_al.sh
run_comqumtocns-u.sh		run_comqumtocns-u.sh
run_comqumtocns-x-al.sh		run_comqumtocns-x-al.sh
run_comqumtocns.sh		run_comqumtocns.sh
run_define.sh		run_define.sh
run_generate-u-al.sh		run_generate-u-al.sh
run_generate-u.sh		run_generate-u.sh
run_generate.sh		run_generate.sh
run_makebs.sh		run_makebs.sh
run_pdbtocomqum-u.sh		run_pdbtocomqum-u.sh
run_pdbtocomqum.sh		run_pdbtocomqum.sh
run_wa0.sh		run_wa0.sh
sort_AChE.sh		sort_AChE.sh

Provide feedback