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More convenient bond type conversion#808

Merged
padix-key merged 1 commit intobiotite-dev:mainfrom
padix-key:bonds
Jun 3, 2025
Merged

More convenient bond type conversion#808
padix-key merged 1 commit intobiotite-dev:mainfrom
padix-key:bonds

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@padix-key
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This PR adds two methods to BondList that makes conversion of bond types within the BondList more convenient:

  • remove_kekulization()
  • convert_bond_type()

@codspeed-hq
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codspeed-hq bot commented May 30, 2025

CodSpeed Performance Report

Merging #808 will not alter performance

Comparing padix-key:bonds (5e3f7fd) with main (ec6d618)

Summary

✅ 59 untouched benchmarks

@padix-key padix-key merged commit 3a96abb into biotite-dev:main Jun 3, 2025
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