Date: Fri Jul 01 2011 - 01:33:14 CDT
I want to switch my simulation from CHARMM to NAMD. The first problem is whether a RHDO crystal shape performs well in NAMD, since NAMD normally do a box or sphere?
Someone reported to do a rotation of the y-axis for the RHDO, so that it can work in NAMD. Has anyone tried this kind of tricks?
Any suggestion is greatly appreciated.
Thanks very much for you kind help
DICP WebMail, http://webmail.dicp.ac.cn
This archive was generated by hypermail 2.1.6 : Mon Dec 31 2012 - 23:20:31 CST