On Sun, Jul 7, 2019 at 11:59 PM Souvik Chakraborty <[email protected]> wrote:
>
> Dear Christoph,
>
> The error is the same. I am attaching here the input_A-A.pot.
I ran:
$ csg_call --ia-type non-bonded --ia-name A-A --options fmatch.xml
convert_potential gromacs --clean input_A-A.pot table_A_A.xvg

and that worked perfectly fine for me.

What version of votca are you using? (see "csg_call --version")

Christoph
>
> -Souvik
>
>
>
> On Wednesday, 3 July 2019 15:17:13 UTC+8, Souvik Chakraborty wrote:
>>
>> Dear users,
>>
>> I have found the errors (snaps are attached herewith) while performing  
>> 'csg_call' to generate table_*.xvg files.  I can see input_*.pot files have 
>> been generated fine.
>>
>>
>> The errors appeared during this command:
>>
>> csg_call --ia-type non-bonded --ia-name A-A --options fmatch.xml 
>> convert_potential gromacs --clean input_A-A.pot table_A_A.xvg
>>
>>
>> Looking for any help.
>>
>> Thanks in advance!
>>
>> Regards,
>>
>> Souvik
>>
>>
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-- 
Christoph Junghans
Web: http://www.compphys.de

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