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[ESPResSo-users] Error
From: |
Muhammad Anwar |
Subject: |
[ESPResSo-users] Error |
Date: |
Wed, 30 Mar 2011 11:25:53 +0200 |
User-agent: |
Thunderbird 2.0.0.24 (X11/20101027) |
Hello,
I am working on polymers melt with length of polymer chain 44 and number
of polymer chain 45 with three potentials
1. Rigid bond
2. Bond_angle_cossquare
3. Lennard Jones Generic
After simulation when i watch trajectories using VMD, particle do not
move, message on terminal is like this
Info) Determining bond structure from distance search ...
ERROR) MolAtom 407: Exceeded maximum number of bonds (12).
ERROR) MolAtom 1145: Exceeded maximum number of bonds (12).
ERROR) MolAtom 1152: Exceeded maximum number of bonds (12).
ERROR) MolAtom 1155: Exceeded maximum number of bonds (12).
The number of fragments become 852, i think fragments should be equal to
number of chains, am i right?
Can anybody help?
Thanks
Best Regards,
Muhammad Anwar
- [ESPResSo-users] Error,
Muhammad Anwar <=