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CAT 0.10.3
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@BvB93 BvB93 released this 17 Jan 13:43
· 108 commits to master since this release
0.10.3
07ef9c0

What's Changed

  • REL: Update master branch after 0.10.2 release by @BvB93 in #223
  • ENH: Allow core.allignment: "surface" for cores with <4 anchor atoms by @BvB93 in #224
  • ENH: Allow the BDE workflow to parse qmflows-style generic keywords by @BvB93 in #225
  • BUG: Fix the BDE core_atom and lig_count keys not being optional by @BvB93 in #226
  • ENH: Expose a keyword for the BDE XYn-preoptimization by @BvB93 in #227

Full Changelog: 0.10.2...0.10.3

Contributors

BvB93
Assets 2
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