[Debichem-devel] Bug#680087: ITP: openmm -- library for molecular dynamics
Andreas Tille
andreas at an3as.eu
Wed Jul 4 07:58:33 UTC 2012
Hi,
check out how fast this ended up on the tasks pages:
http://debian-med.debian.net/tasks/bio-dev#libopenmm4-dev
So it is a good idea to prepare your package in VCS when issuing an ITP
bug. DebiChem might also want to add a Dependency to their tasks.
Kind regards
Andreas.
On Tue, Jul 03, 2012 at 03:38:28PM +0200, Steffen Moeller wrote:
> Package: wnpp
> Severity: wishlist
> Owner: Steffen Moeller <steffen_moeller at gmx.de>
>
> * Package name : openmm
> Version : 4.1
> * URL : https://simtk.org/home/openmm_suite
> * License : custom
> Programming Lang: C++, Python
> Description : library for molecular dynamics
>
> OpenMM is a library which provides tools for modern molecular modeling
> simulation. As a library it can be hooked into any code, allowing that
> code to do molecular modeling with minimal extra coding.
> .
> Moreover, OpenMM has a strong emphasis on hardware acceleration, thus
> providing not just a consistent API, but much greater performance than
> what one could get from just about any other code available.
>
> A package is 2/3rd complete on
> http://anonscm.debian.org/viewvc/debichem/experimental/openmm/debian/
> lacking python packages and various smaller bits like watch files.
>
>
>
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>
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