Geoff,
it's comforting to know that, thanks for the reply.
I've started looking at the code of Andrew (Dalke), but in the meantime, it
would be great
if you could provide other pointers.
Very likely, I would try re-implementing everything in Python, then somebody
with more
experience than me should port that to C++, I guess.
Cheers,
S
On 04/01/2016 09:48 PM, Geoffrey Hutchison wrote:
>> If there's indeed some general interest, and developers think it's feasible,
>> even if in
>> the long run, I would be happy to work on it.
>
> Oh, I think both are feasible and I think we can supply some pointers. The
> problem has been one of "too many things and not enough cooks" rather than
> anything else.
>
> As you say, both have been requested many times. :-)
>
> Cheers,
> -Geoff
>
--
Stefano Forli, PhD
Assistant Professor of Integrative
Structural and Computational Biology,
Molecular Graphics Laboratory
Dept. of Integrative Structural
and Computational Biology, MB-112A
The Scripps Research Institute
10550 North Torrey Pines Road
La Jolla, CA 92037-1000, USA.
tel: +1 (858)784-2055
fax: +1 (858)784-2860
email: fo...@scripps.edu
http://www.scripps.edu/~forli/
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