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From: Shubham Mishra (shubham.root_at_gmail.com)
Date: Mon Feb 01 2016 - 02:25:09 CST
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Thank you Axel,
That was a great help. It would be great to know if it is a good idea
create a molecule (nanoparticle) that big for simulation in limited
computer resources. I was hoping to create a hard sphere/soft sphere
simulation of nanoparticle with a monolayer and give it a repulsive
potential in the solvent I am using to reduce the required computation,
since the size of the system has already become too big. Can that be done
in NAMD or LAMMPS? I have already created my solvent box in NAMD. I just
need to create a capped nanoparticle and solvate it.
Thank you.
Regards,
Shubham Mishra
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