bmrb2talos

Description:

extract chemical section from BMRB file

Usage:

bmrb2talos.py [-h] [-backbone] [-ignore_errors] [-traceback] bmrb [tab]

Detailed Help:

tab chemical shift file
bmrb A bmrb file or the chemical shift section of an bmrb file
-h, --help show this help message and exit
-backbone remove all atoms that are not used by fragment picker: keep CA, CB, C, N, HN, HA
-ignore_errors some bmrb files have corrupted data entries that do not affect the chemical shift data. These errors can be ignored
-traceback print full traceback in case of error

Examples:

bmrb2talos.py 2jrm.bmrb 2jrm.tab
bmrb2talos.py 2jrm.brmb > 2jrm.tab

application: