Harmonic constraint parameter k

From: zhilei chen (zchen4_at_uiuc.edu)
Date: Thu Dec 11 2003 - 08:39:48 CST

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Dear namd user,
 
This is a question about the harmonic constraints force constant. Can
anyone tell me what is the unit of this force constant and what is the
equation used to calculate this force? If I want to set up energy
minimization with harmonic constraints on the CA, are there any rules
about what kind force constant I shall use?
 
Thanks a lot
 
zhilei

• Next message: Jerry Ebalunode: "Which version MPICH-VMI does namd-ia64-vmi run on? intel compiled version or gcc complied version?"
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• Reply: Tim Isgro: "Re: Harmonic constraint parameter k"
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