Dear colleagues,

I'm beginner in C++ programming, I've coded a c++ program to solvate (hydrate) a structure (carbon nanotube for instance). Would you please check it out and give me your comments for possible improvement.

The initial parameters may be:

xbox = ybox = zbox = 50

# of water molecules = 50000

min distance for solvent/solute = 5

min distance for solvent/solvent = 2.7

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