mBuild 0.9.1

Breaking Changes

This is the last release including official support for Python 3.5. It will likely work for some time but mBuild will not be tested on Python 3.5 during development.

Features

• Residue names can optionally be inferred from compound names in conversion to ParmEd (#475)
• Custom cross-interactions (NBFIXES in ParmEd jargon) can now be written to LAMMPS data files (#456)
• The LAMMPS writer now prints helpful comments to more verbosely describe which atom types are associated with each potential (#535)

Maintenance

• Some stylistic changes were made as suggested by various linters (#522)
• Appveyor now tests on Python 3.6 (#520)

Documentation

• Installation docs were updated to explicitly list supported Python versions (#532)
• A comment pointing to the glozter Anaconda channel has been updated to point to conda-forge (#534)

Miscellaneous

• Some tests depending on foyer are now properly skipped when it it not installed (#521)
• Some examples were updated in accordance with their new structure as internal recipes (#536, #538)