[gmx-developers] Developer's Manual

[Erik Lindahl]

On Friday, Mar 21, 2003, at 12:48 US/Pacific, David wrote:

> On Fri, 2003-03-21 at 21:53, Senthil Kandasamy wrote:
>> Hi all,
>>
>> I remember hearing talk about a developers manual being created soon.  
>> Of
>> late, I find myself looking into the source code of most analysis  
>> tools
>> to be able to add my own features into some of them, but am usually  
>> lost
>> in the maze of subroutines. I understand that most of the main
>> developers are immersed in more important code development and
>> documentation is the last thing in their minds. But, is there any
>> preliminary documentation that is available that would basically tell  
>> me
>> where all the libraries and important subroutines are and what they  
>> do?
>> That would help a lot.
>>
> I'm not sure that something has materialized yet (I haven't done
> anything on it). I did however recently propose some changes in the
> analysis model. It would require some assistence from other developers.

I have started documenting the inner loops and a new module for  
nonbonded interactions,
but it is mostly for the next release of Gromacs, so not partiocularly  
useful yet.
>
Cheers,

Erik

> ----------------------------------------------------------------------- 
> ------
Erik Lindahl, MSc, PhD     <lindahl at stanford.edu>
D109, Fairchild Building
Dept. Structural Biology, Stanford University School of Medicine
Tel. 650-7250754    Fax. 650-7238464