Wednesday, May 1, 2019

installation - How do I install ORAC?



ORAC is a 3D chemical modelling software designed for UNIX OS and I have downloaded the tarball http://www.chim.unifi.it/orac/orac.5_3_3.tags.rel_5.3.3.r1963.tar.gz and extracted it but now I have no idea what to do. The README file included read:



Prerequisites:
* GNU Make
* GCC 4.3 or higher
* (possibly) other Fortran 90 compilers


Prerequisites for building the parallel version:
* MPI (Message Passing Interface) libraries and
implementation/environment:
MPICH2 [http://www.mcs.anl.gov/research/projects/mpich2/]
-or-
OPENMPI [http://www.open-mpi.org/]

* also see README_PARALLEL in tests/*/

To build ORAC executable program:


make show # to list all available compilation targets
make

To build a fresh distribution, cleaning all files created by user:

make distro


I am running 32 bit 12.10 and I have GNU Make installed and GCC.




GNU make will compile this for you... Basically, you just have to run make in the orac.5_3_3.r1963 directory.



First you will need the compilation tool required to build ORAC...



remi@host:~/$ sudo apt-get install gfortran


More tools and library might be required too, but you will have to check yourself : as the README doesn't say anything about dependancies, try to compile and see if it fail...




Then let's run make; several targets are supported, let choose default



remi@host:~/orac.5_3_3.r1963$ make default


When the compilation is finished you will find an executable orac_Linux in orac.5_3_3.r1963/src/default


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