Hello Dr.Lemkul
Thank you very much for your answer
I try to do it.
Regards
Azadeh
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On 1/18/18 12:38 AM, kordza...@aut.ac.ir wrote:
Hi all
when we use "gmx energy" what is the difference between LJ-(SR),
LJ-14, Coulomb-14, Coulomb(SR)?
those mentioned energies, give us energy interaction of total system. right?
Not necessarily, because there may be long-range terms from P
Hi all
when we use "gmx energy" what is the difference between LJ-(SR),
LJ-14, Coulomb-14, Coulomb(SR)?
those mentioned energies, give us energy interaction of total system. right?
if I want to determine interaction enenrgy for example, LJ, between two special
species, not in total system, wha