Im trying to run an md or em using an implicit solvation method using
gromacs 4.6 but I always get the incorrect result.
ICC version : icc 11.0
fftw version : 3.2.2
benchmark system is gromacs-gpubench
gromacs-gpubench-dhfr.tar/CPU/dhfr-impl-inf.bench
Angle,Proper Dih,Imp Dih,Nonpolar
On 2013-01-21 09:55, Changwon Yang wrote:
Im trying to run an md or em using an implicit solvation method using
gromacs 4.6 but I always get the incorrect result.
ICC version : icc 11.0
fftw version : 3.2.2
benchmark system is gromacs-gpubench
gromacs-gpubench-dhfr.tar/CPU/dhfr-impl-inf.bench
On Mon, Jan 21, 2013 at 3:55 AM, Changwon Yang sht_yc...@hotmail.comwrote:
Im trying to run an md or em using an implicit solvation method using
gromacs 4.6 but I always get the incorrect result.
ICC version : icc 11.0
fftw version : 3.2.2
benchmark system is gromacs-gpubench
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