On Tue, Feb 10, 2009, Shan-ho Tsai wrote:
>
> Here are some examples of the errors:
These are probably not errors at all, but just reflect the fact that the
bounds-checking code doesn't know how to deal with a older (but not
incorrect) fortran syntax, analogous to the change discussed earlier.
>
>
> cd rdc && ./Run.dip
> 0: Subscript out of range for array name (_nmr.f: 6320)
> subscript=10, lower bound=1, upper bound=1, dimension=1
> ./Run.dip: Program error
> make: *** [test.sander.BASIC] Error 1
>
> cd umbrella && ./Run.umbrella
> 0: Subscript out of range for array name (_nmr.f: 6320)
> subscript=39, lower bound=1, upper bound=1, dimension=1
> ./Run.umbrella: Program error
> make: *** [test.sander.BASIC] Error 1
>
> cd gb1_cox2 && ./Run.cox2
> 0: Subscript out of range for array name (_nmr.f: 6320)
> subscript=5785, lower bound=1, upper bound=1, dimension=1
> ./Run.cox2: Program error
> make: *** [test.sander.GB] Error 1
>
> cd PIMD/part_nmpimd_water && ./Run.nmpimd
> 0: Subscript out of range for array thermostats (_nose_hoover.f: 434)
> subscript=1, lower bound=25, upper bound=24, dimension=1
> ./Run.nmpimd: Program error
> make: *** [test.sander.PIMD.partial] Error 1
>
> cd PIMD/part_nmpimd_ntp && ./Run.nmpimd
> 0: Subscript out of range for array thermostats (_nose_hoover.f: 434)
> subscript=1, lower bound=21505, upper bound=21504, dimension=1
> ./Run.nmpimd: Program error
> make: *** [test.sander.PIMD.partial] Error 1
>
The real question is this: if you turn off bounds checking, which test
cases still fail?
...dac
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Wed Feb 11 2009 - 01:22:24 PST
