[gmx-developers] Gromacs contribution

[Szilárd Páll]

Hi Marija,

Have you found something interesting? If not, we could help to get you
started with some easy to fix redmine issues...


--
Szilárd


On Mon, Jan 22, 2018 at 11:38 PM, Marija Baljkas <mbaljkas2 at gmail.com> wrote:
> I'm quite comfortable with the code in C/C++ and, of course, with some time
> put into it I think i can understand quite well how it fits together.
>
> I'm open for everything to work on but free energy calculations would be
> interesting since I've used Gromacs for that before. I guess i will go
> through the description of how to contribute on Gromacs site and see what is
> there on Gerrit for now :)
>
> Thanks for quick help,
> BR
> Marija
>
> Dana 22. sij 2018. 22:50 osoba "Vedran Miletić" <vedran at miletic.net>
> napisala je:
>
> Pozdrav,
>
> how comfortable are you with C/C++ in terms of reading through existing
> code and understanding how it fits together, what style is used, and
> where it can be extended? I assume you know how to use a debugger and a
> version control system, all other auxiliary steps to contribute are
> documented.
>
> Second, what would you like to work on? There's a ton of things that
> could be extended about free energy, e.g. Thomas Ullmann is working on
> multiple lambdas and we at HITS are working on extending lambda code for
> reactive molecular dynamics. I assume there are more.
>
> Hope this helps.
>
> Regards,
> Vedran
>
> 22.01.2018 u 22:30, Marija Baljkas je napisao/la:
>> Hi,
>>
>> First, I would like to introduce myself. My name is Marija and I'm 23
>> year old from Croatia. I was searching for an open source project to
>> work on in my spare time and Gromacs came to my mind first since I used
>> it actively on college. I have masters degree in computational physics
>> and my master thesis was mostly about calculations of free energy in
>> molecular dynamics. Currently I'm working as a software developer in one
>> international company. I would like to improve my knowledge of
>> programming and also get to know how Gromacs actually works :)
>> I mostly work in C/C++ and sometimes in Java but I'm up for challenge.
>> If you have some advice on how to start, please do tell :D
>>
>> BR,
>> Marija
>>
>>
>>
>
> --
> Vedran Miletić
> vedran.miletic.net
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