Okay Leena, Thanks. But still, I doubt, if everything is correct then why
there are warnings. Further, can you please tell me, how did you decide
that everything is correct?
Thanks.
Rakesh Srivastava
Research Fellow
School of Computational & Integrative Sciences
Jawaharlal Nehru University, New Delhi-110067
India
On Wed, Jun 27, 2018 at 6:00 PM Leena Aggarwal <leena.hrc.gmail.com> wrote:
> Hi Rakesh
>
> These warnings come while reading the input parameters of the script. I do
> not know the exact meaning of these warnings but irrespective of the script
> these always come while running the rism1d script. I think these are just
> the starting warnings which indicate that all the input parameters
> mentioned in the script are read correctly.
> Your script is running correctly.
>
> On Wed, Jun 27, 2018 at 3:54 PM, Rakesh Srivastava <allahabad.21.gmail.com
> >
> wrote:
>
> > Hello Leena, I am attaching the script.
> > Thanks.
> >
> > Rakesh Srivastava
> > Research Fellow
> > School of Computational & Integrative Sciences
> > Jawaharlal Nehru University, New Delhi-110067
> > India
> >
> >
> >
> > On Wed, Jun 27, 2018 at 2:42 PM Leena Aggarwal <leena.hrc.gmail.com>
> > wrote:
> >
> > > Can you send me TP3_NaCl.inp script.
> > >
> > > On Wed, Jun 27, 2018 at 11:04 AM, Rakesh Srivastava <
> > > allahabad.21.gmail.com>
> > > wrote:
> > >
> > > > Hello all, when I run the rism1d script for solvent preparation, the
> > out
> > > > file starts with following warnings. Can you please tell me what
> these
> > > > warnings mean.
> > > >
> > > > reading input data file: TP3_NaCl.inp
> > > > WARNING> 'closur' is deprecated
> > > > WARNING> 'outlst' is deprecated
> > > > WARNING> 'routup' is deprecated
> > > > WARNING> 'toutup' is deprecated
> > > > WARNING> 'kshow' is deprecated
> > > > WARNING> 'nis' is deprecated
> > > > WARNING> 'maxste' is deprecated
> > > > WARNING> 'delvv' is deprecated
> > > > WARNING> 'tolvv' is deprecated
> > > > WARNING> 'temper' is deprecated
> > > >
> > > > Thanks.
> > > >
> > > > Rakesh Srivastava
> > > > Research Fellow
> > > > School of Computational & Integrative Sciences
> > > > Jawaharlal Nehru University, New Delhi-110067
> > > > India
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Received on Wed Jun 27 2018 - 06:00:06 PDT
