interface
reads coordinate files and writes files
of inter-chain residue-residue contact data.
Here is a sample session with interface:
% interface
Mandatory qualifiers:
- [-in] (infile)
-
Name of protein coordinate file for input (EMBL format).
- -vdwf (string)
-
Name of data file with Van der Waals radii.
- -thresh (float)
-
Threshold contact distance.
- [-out] (outfile)
-
Name of contact file for output.
- -conerrf (outfile)
-
Name of log file for the build.
Optional qualifiers:
- -ignore (float)
-
If any two atoms from two different residues are at least this
distance apart, no futher inter-atomic contacts are checked for for
that residue pair. This speeds up the calculation considerably.
|