[gmx-developers] index reading and documentation

Tsjerk Wassenaar tsjerkw at gmail.com
Mon Jan 22 20:34:22 CET 2007


Hi Martin,

> is there any documentation for functions provided by gromacs and it's tools?
> RTFC is also nice but it's difficult to find already implemented functions.
>

No there isn't. There is generally more urge in debugging and adding
new features than in generating proper documentation (but the manual
is quite good).

> in my case, i am looking for an option similar to get_index or rd_index but
> with hardcoded groups e.g. Group1=Protein Group2=SOL to fill a provided index
> and indexcount.
>

You should be able to find the routines which actually build these
groups, by going through get_index/rd_index.

> Cheers
>         Martin


Cheers,

Tsjerk

-- 
Tsjerk A. Wassenaar, Ph.D.
Junior UD (post-doc)
Biomolecular NMR, Bijvoet Center
Utrecht University
Padualaan 8
3584 CH Utrecht
The Netherlands
P: +31-30-2539931
F: +31-30-2537623



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