[gmx-users] problem in em.mdp file
Mark Abraham
Mark.Abraham at anu.edu.au
Thu Nov 6 05:36:55 CET 2008
Bhawana Gupta wrote:
> hello everybody,
> i m sending this mail regarding the problem which i get after using
> grompp command for em.mdp while using *Gromacs 4.0*
> *version*
> ERROR is [file boc2_md_water_em.mdp, line unknown]:
> Right hand side 'le-5' for parameter 'ewald_rtol' in parameter file is
> not a real value
Look closely at your input... "l" is not the same as "1"
Mark
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