AMBER Archive (2008)

Subject: RE: AMBER: AMBER10: Fortran Runtime Error

From: Ross Walker (ross_at_rosswalker.co.uk)
Date: Fri Jul 25 2008 - 16:22:16 CDT

Hi George,

It is a little difficult to help without seeing your actual nuc.in file. Did
you create this yourself or physically download it from the website?

A couple of things to check / try.

1) Add an extra carriage return at the end of the file (i.e. an extra blank
line)

2) check the text file is in Unix and NOT DOS format. On most Linux
installations you can use the command:

dos2unix nuc.in

to force the file to be in Unix format.

If that still doesn't work and your file definitely matches that on the
website then please post your machine specs, OS, compiler versions etc and
we can try to help some more.

All the best
Ross

> -----Original Message-----
> From: owner-amber_at_scripps.edu [mailto:owner-amber_at_scripps.edu] On Behalf
> Of George Tzotzos
> Sent: Friday, July 25, 2008 8:19 AM
> To: amber_at_scripps.edu
> Subject: AMBER: AMBER10: Fortran Runtime Error
>
>
> Please disregard my earlier message. I managed to locate the _nucgen.f
> file that gives a runtime error at line 77.
>
> I"m afraid I cannot see what causes the runtime error. Any help would
> be most welcome.
>
> Cheers
>
> George

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