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v0.1.10

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@ybyygu ybyygu released this 29 Apr 13:14
· 34 commits to master since this release

Changes:

  • [2023-04-29] Molecule: improved fingerprint method to be uniq for different atom kinds or diffent bond kinds.
  • [2023-04-29] Molecule: new symbols and atomic_numbers methods
  • [2023-04-20] Added functions for visualization of molecules using jmol/agui
  • [2023-04-20] Added spdkit-view script for easy viewing of molecular files