| Summary: | ???? Highlights (tldr) Integration with 3Dconnexion input devices on Mac and Windows Many thanks to 3Dconnexion and Patryk Skowroński (@pskowronskiTDx) for this contribution (#1311) Improved rendering including ambient occlusion and real-time shadows from @aerkiaga New template tool for assembly of inorganic complexes and ligands or attaching functional groups (e.g, "click to add phenyl group") from @aerkiaga (#1075) New forcefield framework supporting external Python scripts (e.g., XTB, ASE, ANI-2x, etc.) @ghutchis (#1370) Better perception of bond orders @ghutchis Align tool (#1364) @ghutchis Manual translate / rotate dialog Fetch molecule names from PubChem, including markup Commands to create centroid and center-of-mass points Improved "fill unit cell" (#1375) Preview images of insert molecule fragments and import crystals Build improvements, including initial support for Qt6 and VTK9 fixes @cryos Integrated Orca ouputfile support (from Orca-enhanced Avogadro) (#1326) Add a generic compchem output reader (i.e., should automatically handle <code>.out</code> and <code>.log</code> files) (#1347) Initial scripting support (e.g., used to generate preview images through a directory) (#1344) Several updated toolbar icons ✨ Features Reading Gaussian fchk vibrations when present @ghutchis (#1380) Add support for atom labels (e.g., C1, C2, H1…) in the coordinate editor using "L" symbol @ghutchis (#1362) More pybind methods and properties @ghutchis (#1342) Perceive bond orders when requested by Python scripts @ghutchis (#1211) Support for color PLY format @spotenza2016 (#1177) Tweak the edge detection to allow changing the strength too @ghutchis (#1140) Add copy as SMILES / InChI @ghutchis (#1147) Add atoms for selection in wireframe rendering @ghutchis (#1128) Grab the "markup" name from the PubChem JSON response @ghutchis (#1105) Estimate bond distances in template tool @aerkiaga (#1099) Add formal charge combobox to template tool @aerkiaga (#1090) Add support for undo/redo selections, including ...
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