VMD-L Mailing List
From: Olaf Lenz (olenz_at_fias.uni-frankfurt.de)
Date: Wed Jul 25 2007 - 12:39:39 CDT
- Next message: John Stone: "Re: how to run VMD on IBM machines"
- Previous message: Axel Kohlmeyer: "Re: how to run VMD on IBM machines"
- In reply to: Rachel : "how to wrap trajectory into truncated octahedral box"
- Next in thread: sally cii: "Re: how to wrap trajectory into truncated octahedral box"
- Reply: sally cii: "Re: how to wrap trajectory into truncated octahedral box"
- Messages sorted by: [ date ] [ thread ] [ subject ] [ author ] [ attachment ]
-----BEGIN PGP SIGNED MESSAGE-----
Hash: RIPEMD160
Hi!
Rachel wrote:
> Can anyone tell me how to wrap the trajecotries into a truncated
> octahedral box? thank you for your help.
The pbctools so far are only able to wrap into a parallelepiped or the
corresponding rectangular box. Truncated octahedrons are not supported,
yet. You would be very welcome to extend the pbctools plugin!
Olaf
-----BEGIN PGP SIGNATURE-----
Version: GnuPG v1.4.2 (GNU/Linux)
Comment: Using GnuPG with SUSE - http://enigmail.mozdev.org
iD8DBQFGp4rbtQ3riQ3oo/oRA9k6AJ9XgJU9KRS2WD6REfh83NcnsU9iwACgkHtn
h7lSV6fCi7Lft6VjaqWlyu0=
=2xxy
-----END PGP SIGNATURE-----
- Next message: John Stone: "Re: how to run VMD on IBM machines"
- Previous message: Axel Kohlmeyer: "Re: how to run VMD on IBM machines"
- In reply to: Rachel : "how to wrap trajectory into truncated octahedral box"
- Next in thread: sally cii: "Re: how to wrap trajectory into truncated octahedral box"
- Reply: sally cii: "Re: how to wrap trajectory into truncated octahedral box"
- Messages sorted by: [ date ] [ thread ] [ subject ] [ author ] [ attachment ]
