Ok, at this point you can either head over to the GROMACS source code download page in your browser and choose which version and download it. Now we can install cmake(and for good measure, although not essential, let’s install wgetas well as that will be useful in a moment). Then installing MacPorts itself is simply downloading a package as described on the page. Luckily, to get the latter we’ll install MacPorts, which is a Mac package manager (a bit like apt-geton Ubuntu or yumon CentOS) that let’s you install all sorts of useful Linux tools and Python packages.įirst, therefore, follow the instructions on how to install MacPorts.This does take a bit of time, if you haven’t done it before, as you need to download install Xcode, which is Apple’s Developer environment. We’ll need gccand cmake,netiher of which will be on your Mac by default. These notes are specifically how to compile GROMACS on a Mac.
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