CCL: freeze interval vibrations
- From: "Eric Hu" <list.eric/./gmail.com>
- Subject: CCL: freeze interval vibrations
- Date: Wed, 24 May 2006 13:46:36 -0700
Hi, I am conducting an organic molecular assembly simulation (about 55
atoms in each subunit and there are 12 subunit in total). I want to
freeze the
subunit internal vibration (saving sampling time) during md since
I am more interested in the assembly process between subunits.
Are there any suitable "rigid body" molecular dynamics packages for
this purpose? Thank you.
Eric