Publish to PyPI and GitHub Release

Workflow runs for Publish to PyPI and GitHub Release

• Bump version to 0.9.8: integrated uff-relax 1.0.7, improved placement…

  completed successfully:
  Publish to PyPI and GitHub Release#36:Commit2cc13d3pushedbyForblazeProject
  v0.9.8

  Mar 5, 20263m 28s
  More actions for workflow run 36

• Release v0.9.7: Add GROMACS trajectory support and enhance OpenFF int…

  completed successfully:
  Publish to PyPI and GitHub Release#35:Commit2f2e22cpushedbyForblazeProject
  v0.9.7

  Feb 21, 20263m 55s
  More actions for workflow run 35

• ci: fix github-release token and dependencies

  completed successfully:
  Publish to PyPI and GitHub Release#34:Commit42bf768pushedbyForblazeProject
  v0.9.6

  Feb 18, 20262m 20s
  More actions for workflow run 34

• v0.9.6: Integrate gasteiger-rs for automatic partial charge assignmen…

  failed:
  Publish to PyPI and GitHub Release#33:Commitb93ba4fpushedbyForblazeProject
  v0.9.6

  Feb 18, 20263m 26s
  More actions for workflow run 33

• feat: include sample_recipe.yaml in CLI distribution

  completed successfully:
  Publish to PyPI and GitHub Release#32:Commitfd6b023pushedbyForblazeProject
  v0.9.5

  Feb 17, 20262m 54s
  More actions for workflow run 32

• feat: include sample_recipe.yaml in CLI distribution

  completed successfully:
  Publish to PyPI and GitHub Release#31:Commit774e1d9pushedbyForblazeProject
  v0.9.5

  Feb 17, 20263m 10s
  More actions for workflow run 31

• release: v0.9.4 - Add polymer tacticity control and Molecule.from_pol…

  completed successfully:
  Publish to PyPI and GitHub Release#30:Commit385f05dpushedbyForblazeProject
  v0.9.4

  Feb 16, 20263m 10s
  More actions for workflow run 30

• release: v0.9.3 - Final release with all CLI fixes, ion support, and …

  completed successfully:
  Publish to PyPI and GitHub Release#29:Commit160999bpushedbyForblazeProject
  v0.9.3

  Feb 15, 20263m 19s
  More actions for workflow run 29

• release: v0.9.2 - Implement CLI template/SMILES support, ion parsing,…

  completed successfully:
  Publish to PyPI and GitHub Release#28:Commitfe29aa8pushedbyForblazeProject
  v0.9.2

  Feb 15, 20262m 42s
  More actions for workflow run 28

• release: v0.9.2 - Implement CLI template/SMILES support, ion parsing,…

  completed successfully:
  Publish to PyPI and GitHub Release#27:Commit7ca0f39pushedbyForblazeProject
  v0.9.2

  Feb 15, 20264m 40s
  More actions for workflow run 27

• fix: implement full template and SMILES support in standalone CLI

  completed successfully:
  Publish to PyPI and GitHub Release#26:Commit6271a97pushedbyForblazeProject
  v0.9.1

  Feb 15, 20262m 17s
  More actions for workflow run 26

• fix: include CLI source files by updating .gitignore and adding src/b…

  completed successfully:
  Publish to PyPI and GitHub Release#25:Commitf581ca2pushedbyForblazeProject
  v0.9.1

  Feb 15, 20262m 46s
  More actions for workflow run 25

• Fix release workflow: use stable cross action and set PYO3_NO_PYTHON

  failed:
  Publish to PyPI and GitHub Release#24:Commit97850ecpushedbyForblazeProject
  v0.9.1

  Feb 14, 20262m 48s
  More actions for workflow run 24

• Fix release workflow: decouple wheels and binaries into separate jobs

  failed:
  Publish to PyPI and GitHub Release#23:Commitb4a8710pushedbyForblazeProject
  v0.9.1

  Feb 14, 20263m 2s
  More actions for workflow run 23

• Decouple core from numpy and fix binary build paths in CI

  failed:
  Publish to PyPI and GitHub Release#22:Commite24020cpushedbyForblazeProject
  v0.9.1

  Feb 14, 20262m 37s
  More actions for workflow run 22

• Completely decouple core logic from numpy by using ndarray directly

  failed:
  Publish to PyPI and GitHub Release#21:Commit1357016pushedbyForblazeProject
  v0.9.1

  Feb 14, 20262m 41s
  More actions for workflow run 21

• Decouple standalone binaries from Python: make pyo3 optional and fix …

  failed:
  Publish to PyPI and GitHub Release#20:Commitf609187pushedbyForblazeProject
  v0.9.1

  Feb 14, 20262m 38s
  More actions for workflow run 20

• Fix release workflow: use stable cross action and improve binary disc…

  failed:
  Publish to PyPI and GitHub Release#19:Commit4fc0df1pushedbyForblazeProject
  v0.9.1

  Feb 14, 20262m 48s
  More actions for workflow run 19

• Restructure release workflow: separate wheel and binary builds using …

  failed:
  Publish to PyPI and GitHub Release#18:Commit89c0dd8pushedbyForblazeProject
  v0.9.1

  Feb 14, 20262m 42s
  More actions for workflow run 18

• Fix release workflow: use correct --bin flag and keep build within ma…

  failed:
  Publish to PyPI and GitHub Release#17:Commite61495fpushedbyForblazeProject
  v0.9.1

  Feb 14, 20262m 37s
  More actions for workflow run 17

• Fix release workflow: use maturin-action for both wheel and binary bu…

  failed:
  Publish to PyPI and GitHub Release#16:Commit83fe564pushedbyForblazeProject
  v0.9.1

  Feb 14, 20261m 35s
  More actions for workflow run 16

• Fix release workflow: robust project root detection and enhanced debu…

  failed:
  Publish to PyPI and GitHub Release#15:Commit832ae96pushedbyForblazeProject
  v0.9.1

  Feb 14, 20261m 59s
  More actions for workflow run 15

• Fix release workflow: auto-detect project root and build binaries sep…

  failed:
  Publish to PyPI and GitHub Release#14:Commit83e1987pushedbyForblazeProject
  v0.9.1

  Feb 14, 20263m 1s
  More actions for workflow run 14

• Fix release workflow: use maturin to build binaries via -- separator

  failed:
  Publish to PyPI and GitHub Release#13:Commita4f2392pushedbyForblazeProject
  v0.9.1

  Feb 14, 20262m 28s
  More actions for workflow run 13

• Fix release workflow: clear RUSTC_WRAPPER and add source verification

  failed:
  Publish to PyPI and GitHub Release#12:Commit4c82e51pushedbyForblazeProject
  v0.9.1

  Feb 14, 20262m 44s
  More actions for workflow run 12