0.0.8
Pre-release
Pre-release
What's Changed
- Changed cached_result to be compatible with new QCPortal by @amcisaac in #40
- Update linters and tests for upstream changes by @mattwthompson in #47
- Make molecules from SMILES where possible by @mattwthompson in #46
- Filter results by moeity with Checkmol or SMIRKS/SMARTS by @mattwthompson in #44
- Always load cosmetic attributes by @mattwthompson in #49
Full Changelog: 0.0.7...0.0.8
Contributors
mattwthompson and amcisaac