printub | ubinfo
Print Urey-Bradley info for selected atoms.
printub [parm <name> | parmindex <#> | <#>] [<mask1>] [<mask2>] [out <file>]
[parm <name> | parmindex <#> | <#>]
Name/tag or index of topology. Default is first loaded topology.
[<mask1>]
Atoms to print UB info for.
[<mask2>]
If specified, UB info must match both masks.
[out <file>]
File to print to (default STDOUT).
For specified topology (first by default) either print CHARMM Urey-Bradley info for all atoms in <mask1>
, or print info for bonds with first atom in <mask1>
and second atom in <mask2>
.