SaveAsPDB(1)
Synopsis
SaveAsPDB [-chV] [--cp] [--wd] [--esv=file] [--fs=-1] [--ls=-1] [--si=1] file
Description
Save the system as a PDB file.
Options
- -c, --constrain
- Apply geometric constraints before saving.
- --cp, --copyProperties
- Copy the property file to numbered subdirectories (ignored if not writing to subdirectories).
- --esv=file
- PDB file to build extended system from.
- --fs, --firstSnapshot=-1
- First snapshot to write out (indexed from 0).
- -h, --help
- Print command help and exit.
- --ls, --lastSnapshot=-1
- Last snapshot to write out (indexed from 0).
- --si, --snapshotIncrement=1
- Increment between written snapshots.
- -V, --version
- Print the Force Field X version and exit.
- --wd, --writeToDirectories
- Write snapshots to numbered subdirectories.
Arguments
- file
- The atomic coordinate file in XYZ or ARC format.