Yes, and Jmol will read those mol files and convert them to 3D just like
theyif you use
load xxx.mol filter 2D
(although in the latest prerelease version of Jmol there could be a bug
there. )
Bob
On Sun, Jun 27, 2010 at 9:03 AM, Otis Rothenberger osrot...@chemagic.comwrote:
Bob,
This is a
...just like they were JME files...
On Tue, Jun 29, 2010 at 5:50 PM, Robert Hanson hans...@stolaf.edu wrote:
Yes, and Jmol will read those mol files and convert them to 3D just like
theyif you use
load xxx.mol filter 2D
(although in the latest prerelease version of Jmol there could be a
When the JME editor creates a molfile with JME.molFile(), it saves the
same stereo information contained in the SMILES and the proprietary JME
file. Where the JME file uses -1(up) and -2(down), the JME created
molfile puts a 1(up) and 6(down, go figure) in the connection table's
first
Bob,
This is a point of information that you may already know. I just
discovered it, so I'll point it out just in case it's new information to
you or other JME users.
When the JME editor creates a molfile with JME.molFile(), it saves the
same stereo information contained in the SMILES and the
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