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Friday, 09 September 2005 |
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Once GROMACS is configured it is trivial to compile it. Just type
or, if you want to have a log of the build process,
If you have already compile the normal version of GROMACS and only want e.g. an MPI version of mdrun, you could instead use
If you are using GNU make (any Linux system) and have more than one CPU you can do a parallel build by adding the option "-j N", where N is the number of build threads. It compiles amazingly fast on a 16-way SMP machine!
Otherwise - sit back and wait for the package to compile. Once it's done you might want to check the output of the make command, or at least make sure there weren't any fatal errors.
Take me to the last step!
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