[gmx-users] Ewald sum./Open BSD
gmx at 4ka.mipt.ru
gmx at 4ka.mipt.ru
Wed Jun 11 16:07:01 CEST 2003
>> ( so, now i dont use xtc formats for traj.)
>> Can it be the reason for crashing mdrun?
>not likely., How about fftw? did you compile yourself?
I have fftw-2.1.3 installed.
I compiled it from ports .
>
> VBut normal ewald doesn't use it. How about your math library? Does it
> have working erf and erfc?
It seems to work properly at first sight...
<skiped>
lala
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