Dear all,
I tried to install CHARMM v47b1 on a Macbook M1 arm running OSX 13.0. I installed first gfortran 12.2.0,
The first step (configure) display a number of warnings and some steps failed but finish "normally" with the message:
you are now ready to run make in
/Applications/charmm/build/cmake
The second step "make -C build/cmake install" starts correctly but stops with the error message:
[ 63%] Building Fortran object CMakeFiles/charmm_fortran.dir/fsshake.F90.o
/Applications/charmm/build/cmake/fsshake.F90:498:53:
391 | call sort(nother,exch5,order5,itemp,jtemp,ktemp,0,0,0,0,3)
| 2
......
498 | call sort(mshkgp,exch5,order5,nshkgp,bshkgp,0,0,0,0,0,2)
| 1
Erreur: Rang non concordant entre l'argument effectif à (1) et l'argument effectif à (2) (rang 1 et scalaire)
make[3]: *** [CMakeFiles/charmm_fortran.dir/fsshake.F90.o] Error 1
make[2]: *** [CMakeFiles/charmm_fortran.dir/fsshake.F90.o.provides] Error 2
make[1]: *** [CMakeFiles/charmm_fortran.dir/all] Error 2
make: *** [all] Error 2
Any suggestion ? Does anyone compile charmm on a MacBook M1 arm running OSX 13.0 ? And how to do it ?
Thanks in advance.
Best regards.
Philippe Cuniasse.