Dear Dave,
Thank you for your response.
Here is my input file-
Analysis of A2 for bonding energy
1 0 0 0 0 1
0 0.0 0.0 0.0 0.0
1 0 3 1 100 1
888.0 2.0 1.2 1
1 99.0 99.0 99.0 99.0 99.0 99.0 99.0 99.0 99.0
ENERGY
Ligand in Sub-unit-1
RES 256
END
Ligand in Sub-unit-2
RES 512
END
END
STOP
And first few lines of .top file are-
%VERSION VERSION_STAMP = V0001.000 DATE = 07/23/04 17:07:47
%FLAG TITLE
%FORMAT(20a4)
%FLAG POINTERS
%FORMAT(10I8)
56904 19 52879 4110 9272 5614 17362 12098 0 0
109981 16778 4110 5614 12098 67 142 68 41 1
0 0 0 0 0 0 0 1 70 0
0
%FLAG ATOM_NAME
%FORMAT(20a4)
N H1 H2 H3 CA HA CB HB2 HB3 CG HG2 HG3 SD CE HE1 HE2 HE3 C O N
H CA HA CB HB2 HB3 CG OD1 OD2 C O N H CA HA CB HB2 HB3 CG HG
Best Regards,
Osman
-----Original Message-----
From: owner-amber.scripps.edu [mailto:owner-amber.scripps.edu]On Behalf
Of David A. Case
Sent: 17. august 2004 03:34
To: amber.scripps.edu
Subject: Re: AMBER: ANAL memory problem.
On Mon, Aug 16, 2004, Osman Gani wrote:
> I am running ANAL (AMBER8) on Redhat Linux 8,0 (2 Xeon 2,8 processors on
> Dell Computer). I got exactly the same message in
> http://amber.ch.ic.ac.uk/archive/200308/0062.html
>
> Here is my output message-
>
> Hollerith memory requirement of: 0 exceeds MAXHOL of 100000
Can you post your input files? We need to be able to reproduce this problem
before trying to debug it. Now that we know that it happens on a standard
architecture (RH Linux, Xeons) we should be able to have a go at it.
....thx...dac
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Received on Tue Aug 17 2004 - 18:53:02 PDT
