ok, I'll try to debug this program and I let you know if I manage to fix it.
I also send the input files I used, if someone else wants to try...
thanks!
guillaume
David A. Case wrote:
> On Mon, Jun 16, 2008, Guillaume Renvez wrote:
>
>
>
>> I'm trying to do a normal mode calculation (with nmode, Amber 8) with
>> the flag ipol = 1, but the program crashes quickly with a "segmentation
>> fault" error message.
>>
>
> I don't know if anyone has used the ipol=1 option in nmode for a long time!
> (I have never used it). This capability was put in by Jim Caldwell (I think),
> and he is reading this list and may remember something. [I'll cc this to him
> as well.]
>
> You may well have to turn on a debugger and try to track this down. People on
> the list might be willing to help, but we would need all the needed files
> (including the prmtop file you are using), in order to give it a try.
>
> ...regards...dac
>
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Received on Wed Jun 18 2008 - 06:07:42 PDT
