[gmx-users] pull DNA

qwp qi-wenpeng at mail.sdu.edu.cn
Wed Aug 31 08:17:55 CEST 2005


hello everyone:
i used the pull code in gromacs-3.2.1 to pull the dickerson DNA, use ffamber94 force field. 
i fixed six carbon atomsin one end(3 on each chain ), and pull six in the other end of DNA.
The velocity is 0.0004nm/ps. The k is 10000 kJ/(mol.nm.nm).i simulate 3ns.
The DNA is stretched, but it isn't unzip.why ?
thanks alot in advance. 





Qi-wenpeng,qi-wenpeng at mail.sdu.edu.cn
2005-8-31 
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20050831/87f1c1e4/attachment.html>


More information about the gromacs.org_gmx-users mailing list