Hi Sailu,
I recommend you use Gaussian 03 to do the calculation.
If you have Gaussian03 installed. You can use the command is like "g03 < example.com > example.log file". (com file is the input file while log file is the output file.)
Hope that helps,
Pengfei
On Jan 24, 2015, at 6:14 AM, sailu <sai.ktp.gmail.com> wrote:
> Hello amber users,
>
> I just followed the MCPB tutorial to parameterize ZN metal of my protein.
> I have run the blc script for sidechain model and generated the gaussian
> input files for optimization. Then, how to run optimization using gaussian
> ! Any script available to run this job? Please help in this reg.
>
> Thanking you
>
>
> --
> *Sarvagalla sailu,*
> *Ph.D.scholar,*
> *Centre for Bioinformatics,*
> *School of Life Sciences,*
> *Pondicherry University**,*
> *Kalapet,*
> *Puducherry - 605014**,*
> *INDIA**.*
> *Mobile: +91-9963202788,**+91-9943923258*
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Received on Sat Jan 24 2015 - 05:00:02 PST
