Re: [cclib-devel] GSoC OpenSource Contribution

[Karol L. <kar...@gm...>]

Hi Mithlesh,

I think for this project the place to start is writing a crawler that would
find an index the logfile we keep in our repository for unit tests:
https://github.com/cclib/cclib/tree/master/data

Beyond that, I think that we would like to see an application that
describes a reasonable crawling process. This can become tricky due to the
scale of everything out there.

On Thu, Mar 8, 2018 at 4:41 AM, <mit...@ii...> wrote:

> Hello Sir,
> I would like to dive deep in Discovering computational chemistry content
> online.
> Sir where I can start? I mean discuss ideas. Please help Sir!
> Thanks Sir
> Mithlesh Kumar
> #copied from wiki.openchemistry.com ideas.
> Brief explanation: There are tens or hundreds of thousands of
> computational chemistry results available online - let's mine them!
>
> Expected results: Build a crawler that identifies and indexes
> computational chemistry content online, and provides the ability to
> extract data with cclib.
>
> Prerequisites: Experience with Python, and ideally familiarity with
> computational chemistry and web indexing.
>
>
>
>
>
> > Hello Mithlesh,
> >
> > There is still plenty of time to submit proposals - please follow the
> GSOC
> > timeline: https://developers.google.com/open-source/gsoc/timeline
> >
> > First of all, I would encourage you to look through the various ideas on
> > the OpenChemistry website:
> > http://wiki.openchemistry.org/GSoC_Ideas_2018#cclib_Project_Ideas, also
> > for
> > the other libraries, not only cclib. Try to find a project you think you
> > are a good fit for and would have fun doing.
> >
> > Best,
> > Karol
> >
> >
> > On Tue, Mar 6, 2018 at 1:04 PM, <mit...@ii...> wrote:
> >
> >> Hi Sir,
> >> I am currently pursuing B.Tech at Indian Institute of Technology
> >> Guwahati
> >> in Chemistry major. I have keen interest in Quantum Chemistry and
> >> Computational. I have already taken Computational Chemistry course in
> >> this
> >> semester . I have much experience with many programming languages
> >> especially Python,C/C++,Java. I love to contribute Open Chemistry
> >> (cclib)
> >> under your guidance. I know there is much less time to submit proposal.
> >> But I am quiet sure that I can do alot better.
> >> Thanks Sir for considering me
> >> Mithlesh Kumar
> >>
> >
>