AMBER Archive (2006)

Subject: RE: AMBER: RESP problem

From: Ross Walker (
Date: Tue Apr 11 2006 - 10:08:25 CDT

> I then ran the output file though espgen to generate a file
> for resp. I then ran resp using the following script;
> resp for tNAD - from gaussian98 output - 11/04/06
> &cntrl inopt=0, ioutopt=0, nmol=1, ihfree=1
> &end
> 1.0
> forrtl: severe (24): end-of-file during read, unit 5, file
> /tNAD/G98-RESP/

A couple of things to quickly try.

1) Change &end to / some compilers don't like the &end to end a namelist.

2) Check your file is in unix format and not dos. Try opening it with vi and
take a look at the bottom of the screen as it opens, does it say Dos? You
can use dos2unix to convert it to unix if required.

All the best

|\oss Walker

| HPC Consultant and Staff Scientist |
| San Diego Supercomputer Center |
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