AMBER Archive (2003)

Subject: Re: AMBER: increase size of NATOM or NRES for "ambpdb"

From: David A. Case (case_at_scripps.edu)
Date: Mon Sep 22 2003 - 14:24:12 CDT

On Mon, Sep 22, 2003, Wen Li wrote:
>
> I am trying to run "ambpdb" to generate a pdb (a large system) from a
> restart file of an MD run. The message was: "NATOM or NRES is too big".
> Which source code program should I change to increase the size?

Source code is in amber7/src/etc/ambpdb.f. Using "find" or a file-searching
program should help you out in cases like this.

..good luck...dac 

-- 

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David A. Case                     |  e-mail:      case_at_scripps.edu
Dept. of Molecular Biology, TPC15 |  fax:          +1-858-784-8896
The Scripps Research Institute    |  phone:        +1-858-784-9768
10550 N. Torrey Pines Rd.         |  home page:                   
La Jolla CA 92037  USA            |    http://www.scripps.edu/case
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