[gmx-developers] force field reorganization

[Berk Hess]

Anton Feenstra wrote:
> Sounds very good!
>
> Mark Abraham wrote:
>> Good idea.
>>
> [...]
>> Should grompp and pdb2gmx have a verbose mode that is able to report
>> which file contributed which piece of data?
>
> That sounds like a good addition (if Berk didn't put it in already).
>
All Gromacs programs, including grompp and pdb2gmx already print which
library files they read.
Printing which residue topology is taken from which file is not practical,
since this could result in thousands of messages.
It would be possible to print from which files information is taken, but
that is a lot of work.
I hope the file opening and rtp entry replacement messages are sufficient.

Berk