Re: ADP again

From: Brian Bennion (brian_at_youkai.llnl.gov)
Date: Sun Nov 16 2003 - 00:26:00 CST

you can change the name of the parameter file that namd reads in the namd
config file...
change the 22 to 27 in the line that states par_all27_prot_lipid.inp

Brian

On Sun, 16 Nov 2003, himanshu chandola wrote:

> Dear all,
> I am again stuck with ADP. I can generate the psf file thanks to
> the ADP parameters in the charmm 27 param file. But when i use the
> correspondingly generated files for namd - i have this CN7 atom in the
> ADP which is not in the charmm 22 file (i guess namd only accepts charmm
> 19 and 22 param files). So i encounter an error.
>
> Any workarounds please ?
>
> himanshu
>
> ----------------------------------------
> Morpheus: Do you believe in fate, Neo?
> Neo: No.
> Morpheus: Why Not?
> Neo: Because I don't like the idea that I'm not in control of my life.
>
>

-- 
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**Brian Bennion, Ph.D.                                         **
**Computational and Systems Biology Division                   **
**Biology and Biotechnology Research Program                   **
**Lawrence Livermore National Laboratory                       **
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