Thanks for your reply Alex.


‌

On 23 February 2018 at 02:01, Alex <nedoma...@gmail.com> wrote:

> No, this is the particle-particle cutoff portion in the particle-particle
> + particle-mesh scheme. Unless the size of your entire protein is smaller
> than rcoulomb.
>
> Alex
>
>
> On 2/22/2018 1:07 PM, Saumyak Mukherjee wrote:
>
>> Dear Users,
>>
>> In the output of gmx energy, coul-SR means short range Coulomb
>> interactions. So if I have coul-SR for a protein, does it give the total
>> self-interaction energy (Coulomb) of the protein?
>>
>> Any help is much appreciated.
>>
>> Thanks & regards,
>>
>> *Saumyak Mukherjee*
>>
>> Senior Research Fellow,
>> Prof. Biman Bagchi's Lab,
>> Solid State and Structural Chemistry Unit,
>> Indian Institute of Science,
>> Bangalore - 560012,
>> Karnataka, India.
>>
>>
>>
>>
>>
>> ‌
>>
>
> --
> Gromacs Users mailing list
>
> * Please search the archive at http://www.gromacs.org/Support
> /Mailing_Lists/GMX-Users_List before posting!
>
> * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
>
> * For (un)subscribe requests visit
> https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or
> send a mail to gmx-users-requ...@gromacs.org.




-- 
Thanks & regards,

*Saumyak Mukherjee*

Senior Research Fellow,
Prof. Biman Bagchi's Lab,
Solid State and Structural Chemistry Unit,
Indian Institute of Science,
Bangalore - 560012,
Karnataka, India.
-- 
Gromacs Users mailing list

* Please search the archive at 
http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting!

* Can't post? Read http://www.gromacs.org/Support/Mailing_Lists

* For (un)subscribe requests visit
https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a 
mail to gmx-users-requ...@gromacs.org.

Reply via email to