[gmx-users] Strange solvation error

Raj Badhan r.k.badhan at stud.man.ac.uk
Mon Dec 1 10:57:01 CET 2003

Dear Anton (and everybody)
My box size is cubic with 0.7 distance between box and molecule.
I can do the same simulation using the dimer in a water box 
without ATP, but when I come to add ATP using the drug-enzyme 
tutorial, this occurs.
I am running this on the windows version, if that helps.
Any advice would be appreciated.
Many thanks
Raj Badhan
Postgraduate researcher
School of Pharmacy and Pharmacetical Science
The University of Manchester
Manchester, UK.

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