[Molecularmechanics] Request for comments

[Peter Murray-Rust]

At 12:38 07/11/2003 +0100, Konrad Hinsen wrote:
>In order to focus the discussion on more concrete issues, I have put two
>explicit format proposals on the Wiki. The first is the one presented by
>David at the FSAtom tutorial, the second is a slightly refined version of
>what I proposed on this list recently. The refinements were added in the
>process of actually implementing the format :-)
>
>Please have a look at the bottom of the page
>
>   http://dirac.cnrs-orleans.fr/fsatom_wiki/StructuralData
>
>and give your comments!

Thanks,

         Since the second is based on CML I have commented on this *on the 
page* about the (relatively small) differences from CML and things that 
need to be added to the language.

         Since I do not implement forcefield programs I'll take a neutral 
position between the two proposals, but note that David's is closer to the 
crystallographic topology files as it combines chemical constitution and 
perception for forcefields.

P.