[AMBER-Developers] nb_pairlist.F90

From: Brent Krueger <kruegerb.hope.edu>
Date: Thu, 12 Apr 2018 08:20:11 -0400

 I just posted a build failure to the wiki tests page. My system is very
old, so I don't think this failure needs to be a concern.

However, the way in which the mpi build died, worries me that this may be a
more general issue that other compilers gloss over. Perhaps that means its
fine. But perhaps this is a bug waiting to happen. Anyway, I wanted to post
it here to alert folks who might ignore my ancient system in the list of
things on the wiki:


mpiifort -DMPI -DMKL -DBINTRAJ -DEMIL -DFFTW_FFT -DMKL_FFTW_FFT -ipo -O3
-no-prec-div -axSSE4.2,SSE3 -I/home/krieg/source/amber18/include -c
nb_pairlist.F90 nb_pairlist.F90(3239): error #8018: The memory reference
associated with an ASSUME_ALIGNED directive must not be in COMMON, a field
reference, use associated, or host associated. [PROC_ATM_TO_FULL_LIST]
\!DIR$ ASSUME_ALIGNED
x_crd_j:64,y_crd_j:64,z_crd_j:64,atm_j_lst:64,proc_atm_to_full_list:64,
atm_j_excl_list:64

________________________________
^

compilation aborted for nb_pairlist.F90 (code 1)


Oh, this is Intel v 12.0.0 using -intelmpi on really old CentOS/RH 5.6

Cheers,
Brent


-- 
_______________________________________________
Brent P. Krueger.....................phone:   616 395 7629
Professor.................................fax:       616 395 7118
Hope College..........................Schaap Hall 2120
Department of Chemistry
Holland, MI     49423
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Received on Thu Apr 12 2018 - 05:30:02 PDT
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