[gmx-users] solvent spatial distribution
Jinyao Wang
wangjy at ciac.jl.cn
Fri Dec 26 15:34:49 CET 2008
gmx-users,
I have computed the rdf between a atom of solvent and a atom of solute
and get rmin=0.43nm.I have also known the g_spatial can compute
the solvent spatial distribution around a atom of solute. I could get
a 3D solvent spatial distribution plot if I load the grid.cube into VMD.
But if I want to get a 3D solvent spatial distribution plot within r<=0.43nm,
I don't know how to do it. Any suggestion will be appreciated.
Happy New Year for everone in advance.
Jinyao Wang
wangjy at ciac.jl.cn
2008-12-26
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