Hi Rizwan,
See extra_pts.f for the 1-4 interactions for Ewald / PME runs etc.
See ephi() in ene.f for the 1-4 interactions for GB etc.
See short_ene() in short_ene.f for VDW in Ewald / PME runs etc.
See short_ene_dip() in short_ene.f for VDW in Ewald / PME runs with
polarizable force fields.
See egb() in egb.f for the VDW interactions for GB runs.
Good luck,
Ross
> -----Original Message-----
> From: amber-bounces.ambermd.org [mailto:amber-bounces.ambermd.org] On
> Behalf Of Rizwan Tai
> Sent: Monday, August 03, 2009 10:13 AM
> To: AMBER Mailing List
> Subject: [AMBER] Lennard Jones potential
>
> Hello, I am an undergraduate research student. I'm working with Amber 6
> and
> Amber 9. Can someone please help us find Lennard Jones subroutine. If
> anyone
> knows which file to look into, can you please help us?
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Received on Wed Aug 19 2009 - 20:19:04 PDT
