[gmx-developers] pme.c error in the CVS code ...

Xavier Periole x.periole at rug.nl
Thu Aug 4 15:57:44 CEST 2005

> mpicc -DHAVE_CONFIG_H -I. -I. -I../../src -I/usr/X11R6/include 
> -I../../include -DGMXLIBDIR=\"/data1/periole/GROCVS2//share/top\" -O3
> -fomit-frame-pointer -finline-functions -Wall -Wno-unused 
> -malign-double -funroll-all-loops -c pme.c -MT pme.lo -MD -MP -MF 
> .deps/pme.TPlo -o pme.o
> pme.c: In function `spread_q_bsplines':
> pme.c:486: structure has no member named `pfft'
> mpicc: No such file or directory
> make[1]: *** [pme.lo] Error 1
> The code at lign 484 is a bit strange ... could you have a look.
went throught after changing the code ligne 486:
before :
#ifdef GMX_MPI
#if (defined GMX_MPI && !defined GMX_WITHOUT_FFTW)

This way it is the same test as in ligne 354 !!!! I am not sure this is 
good for the
code in general but this way my compilatin goes through !!!!!

> The compilation goes further .... anmd ends with the message again:
> make[1]: *** No rule to make target `../mdlib/libmd_mpi.la', needed by 
> `mdrun'.  Stop.
Magically this error is also gone !!!


 Xavier Periole - Ph.D.

 Dept. of Biophysical Chemistry / MD Group   
 Univ. of Groningen
 Nijenborgh 4
 9747 AG Groningen
 The Netherlands
 Tel: +31-503634329
 Fax: +31-503634800
 email: x.periole at rug.nl
 web-page: http://md.chem.rug.nl/~periole

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