SimonEnsemble / PorousMaterials.jl

Julia package towards classical molecular modeling of nanoporous materials
GNU General Public License v3.0
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Xtals dep #173

Closed eahenle closed 3 years ago

eahenle commented 3 years ago

Refactor to use Xtals as a dependency (currently v0.2.0). Xtals bindings are re-exported w/ @reexport. Solves some cross-dep issues and unifies divergent implementations between the two packages (e.g. bond graph implementation was obsolete vs. the MetaGraph version in Xtals).

Removed duplicated code. Some cleanup in misc.jl still to do, but can wait until after synchronization w/ Xtals v0.2.3

Suggest registering as PorousMaterials v0.4.0