Trying to build an AtomGraph from a file doesn't seem to work if the path provided as input_file_path is a relative path.
julia> AtomGraph("test/test_data/strucs/mp-195.cif")
┌ Warning: Unable to build graph for test/test_data/strucs/mp-195.cif
└ @ ChemistryFeaturization.Atoms ~/Chemellia/ChemistryFeaturization.jl/src/atoms/atomgraph.jl:107
missing
This seems to be because rc[:paths][:crystals] = @__DIR__, that Xtals.jl requires (see here) hasn't been defined for relocatability with package compiler reasons (see discussion here).
Trying to build an
AtomGraph
from a file doesn't seem to work if the path provided asinput_file_path
is a relative path.This seems to be because
rc[:paths][:crystals] = @__DIR__
, that Xtals.jl requires (see here) hasn't been defined for relocatability with package compiler reasons (see discussion here).