[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



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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