[gmx-users] Simulated Annealing

Shan Jayasinghe shanjayasinghe2011 at gmail.com
Fri Feb 1 22:46:05 CET 2019


Dear Gromacs Users,

I did a simulated annealing for my system and now I want to analyse my
data. Can anyone suggest me a tutorial for this? What type of information
we can get from simulated annealing?

I want to know whether the generated .gro file corresponds to the last
temperature we defined in mdp file?

Thank you.

-- 
Best Regards
Shan Jayasinghe


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