supycomb1
Manual page for supycomb 2024.9.0
Overview
usage: supycomp [OPTIONS] FILES
Align several models and calculate NSD
positional arguments:
- FILE
-
pdb files to align
options:
-
-h, --help -
show this help message and exit
-
-v, --verbose -
switch to verbose mode
-
-V, --version -
show program's version number and exit
-
-m, --mode {SLOW,FAST} -
Either SLOW or FAST, default: SLOW)
-
-e, --enantiomorphs {YES,NO} -
Search enantiomorphs, YES or NO, default: YES)
-
-q, --quiet {ON,OFF} -
Hide log or not, default: ON
-
-g, --gui {YES,NO} -
Use GUI for figures or not, default: YES
-
-o, --output OUTPUT -
output filename, default: aligned.pdb
supycomb is an open-source implementation of [J. Appl. Cryst. (2001). 34, 33-41](doi:10.1107/S0021889800014126). The main difference with supcomb: the fast mode does not re-bin beads. It only refines the best matching orientation which provides a speed-up of a factor 8.
Releases
2 releases since Debian 12 (Bookworm); the text changed 1 time.