This is the documentation for the Julia interface to the chemfiles library.
You will need to use a recet version of Julia (Julia >= 0.5
), and then you
can install the Chemfiles
package by running the following at Julia prompt:
julia> Pkg.add("Chemfiles")
julia> # You may also want to run the test suite with:
julia> Pkg.test("Chemfiles")
This section contains example of how to use Chemfiles.jl, and the complete interface reference for all the types and functions in chemfiles.