[gmx-users] simulations of crystal cell possible?

Rongliang Wu wurl04 at iccas.ac.cn
Sat Nov 18 08:05:40 CET 2006

hello everyone,
does anybody know how to simulate crystal cells in gromacs?
since the cell size has to be no smaller than twice the cutoff.
and if cutoff is too small, the program terminates because of the thus
caused too high energy. my cell is very small about 0.7 nm.


Rongliang Wu


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