Dear shome sankar bhunia,
> I am trying to create a RESP input file from the following script.
> Please find the attachment. I have generated a GAMESS .dat file according
> to instructions mentioned in the script. when i am trying to run the script
> error is as follows "ERROR:- not enough arguments given." (as mentioned in
> the script). Do any one have an idea how to resolve it? Thanks in advance.
This script is now totally included in the R.E.D. III.4 program
available for download .
http://q4md-forcefieldtools.org/RED/. You
could also use R.E.D. Server/R.E.D. IV which provides the
hardware/software for charge derivation and force field library
building .
http://q4md-forcefieldtools.org/REDS/. Tutorials are at
http://q4md-forcefieldtools.org/Tutorial/.
regards, Francois
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Received on Mon Sep 26 2011 - 05:00:04 PDT
