Hi, for those planning to attend the BO dinner in DC, here are four
possible places around the convention center. If anybody knows of/
prefers any other place that's fine. Whatever we choose, we'll
probably need to make reservations soon.
http://www.jaleo.com/ (Tapas, ~ 4 blocks from
Hi,
I am looking for a way to produce a 2D vector image from 3D data (like
pov-(ray)-File).
The background of my question is of course these nice pseudo ray-traced
raster images written by many chemical modeling programs, which are
difficult to handle if you want to change something on them or
Thanks a lot.
I'm happy with Rajarshi's preferences, with a slight personal
preference for the PS7.
Cheers,
Chris
On 3 Aug 2009, at 02:17, Rajarshi Guha wrote:
Hi, for those planning to attend the BO dinner in DC, here are four
possible places around the convention center. If anybody
Hi Rajarshi,
I think I missed the post where the date of the dinner was announced.
Can you please re-post?
Thanks,
-greg
On Mon, Aug 3, 2009 at 2:17 AM, Rajarshi Guharajarshi.g...@gmail.com wrote:
Hi, for those planning to attend the BO dinner in DC, here are four
possible places around the
Hi,
ernst-georg.sch...@bayerbbs.com wrote:
Most programs
in my field which I have tried do not export vector graphics. (Some
older ones will write postscript but their output is not acceptable for
some other reason).
pstoedit can convert ps and eps to svg.
Oh, yes, sorry for being unclear.
On Mon, Aug 3, 2009 at 5:36 PM, Geoffrey Hutchison
ge...@geoffhutchison.net wrote:
Hi Peter,
When you visited Pittsburgh this spring, I mentioned Avogadro and that
we were interested in representing as much as possible in our CML files.
First off... grids / cubes. We plot molecular surfaces,
On Aug 3, 2009, at 1:36 PM, David C.Lonie wrote:
cml xmlns=http://www.xml-cml.org/schema;
convention=cml:conformerList
molecule id=m1_1... contents... /molecule
FWIW, all that Avogadro uses for conformers (at the moment, subject to
change!) are sets of coordinates and an energy.
Yes,
Geoffrey Hutchison wrote:
Isn't there a way you could have multiple coordinate sets inside
molecule/molecule pairs?
You could store the various coordinates and energies as properties of a
molecule... something along the lines of:
molecule id=m1 xmlns=http://www.xml-cml.org/schema;
If it were a line drawing. But there are cylinders and spheres
representing bonds and atoms. And then there is the question of sorting
How are those primitives described? As polygon meshes or centerpoint(s)
with radius? It would be great to have a look at an example...
these elements into a
