Prepare release#32
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TieuLongPhan
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Aug 6, 2025
* Refractor (#26) * update refractor * fix reactor * fix lint * prepare bechmark * refractor MODReactor and SynReactor * update crn * refractor cluster, change to matcher, fix code synreactor, now resnow comparable to modreactor * test 3 os * test * test * fix workflow * fix lint * fix win * fix win * fix win again * update smart * add synreactor implicit hydrogen * fix mcsmatcher * refractor visualization * fix conflict rdkit, upgrade to 2025.3.1 * fix lint * move aam_validator to Chem submodule * fix lint * prepare benchmark matcher * change backend rule to mod * prepare doc * add doc * update fih * update graph module doc * update doc * prepare release * . * fix doc * clean doc * fix docstring * fix tutorial * update fig * update explicit_hydrogen for its * prepare release * build doc * fix lint * fix bug in explicit hydrogen for ITS * fix build * fix * fix * fix * fix doc * update nauty canon, rule filters, change benchmark * prepare release * fix bug in nauty alg * update doc * add features for expanding its * add rule_matcher.py * add testcase rule matcher * add wildcard for smiles * add partial engine * update new features * update document * add data * update Chem features * format docstring and refractor Chem module * add auto-test pypi * create dependabot * test run yml * test * test docker * add docker * add docker * . * add readme * rename * release docker * remove redundant file * Prepare release bump version (#27) * update refractor * fix reactor * fix lint * prepare bechmark * refractor MODReactor and SynReactor * update crn * refractor cluster, change to matcher, fix code synreactor, now resnow comparable to modreactor * test 3 os * test * test * fix workflow * fix lint * fix win * fix win * fix win again * update smart * add synreactor implicit hydrogen * fix mcsmatcher * refractor visualization * fix conflict rdkit, upgrade to 2025.3.1 * fix lint * move aam_validator to Chem submodule * fix lint * prepare benchmark matcher * change backend rule to mod * prepare doc * add doc * update fih * update graph module doc * update doc * prepare release * . * fix doc * clean doc * fix docstring * fix tutorial * update fig * update explicit_hydrogen for its * prepare release * build doc * fix lint * fix bug in explicit hydrogen for ITS * fix build * fix * fix * fix * fix doc * update nauty canon, rule filters, change benchmark * prepare release * fix bug in nauty alg * update doc * add features for expanding its * add rule_matcher.py * add testcase rule matcher * add wildcard for smiles * add partial engine * update new features * update document * add data * update Chem features * format docstring and refractor Chem module * add auto-test pypi * create dependabot * test run yml * test * test docker * add docker * add docker * . * add readme * rename * release docker * remove redundant file * fix lint * fix bug * fix lint * add partial its beta * test publising conda * test publising conda * fix workflow * fix workflow * fix workflow * fix workflow again * tes pre-release * tes pre-release * tes pre-release * tes pre-release * tes pre-release * tes pre-release * fix meta.yaml * fix meta.yaml * fix meta.yaml * fix meta.yaml * fix meta.yaml * fix meta.yaml * publish beta * publish beta * debug * debug * debug * debug * debug * debug * debug * debug * prepare release * pass test staging, prepare release * quick fix hydrogen * prepare release * Prepare release (#30) * add partial its construction and imbaengine * add wildcard and placeholder * add testcase * add mtg * fix bug mtg * prepare release * Prepare release (#32) * add partial its construction and imbaengine * add wildcard and placeholder * add testcase * add mtg * fix bug mtg * prepare release * enhance ITSConstruction to capture hydrogen * add constraint for searching embedding * fix hydro * enhance batch reactor * add postprocess * fix cycle import and add data example
TieuLongPhan
added a commit
that referenced
this pull request
Aug 6, 2025
* Refractor (#26) * update refractor * fix reactor * fix lint * prepare bechmark * refractor MODReactor and SynReactor * update crn * refractor cluster, change to matcher, fix code synreactor, now resnow comparable to modreactor * test 3 os * test * test * fix workflow * fix lint * fix win * fix win * fix win again * update smart * add synreactor implicit hydrogen * fix mcsmatcher * refractor visualization * fix conflict rdkit, upgrade to 2025.3.1 * fix lint * move aam_validator to Chem submodule * fix lint * prepare benchmark matcher * change backend rule to mod * prepare doc * add doc * update fih * update graph module doc * update doc * prepare release * . * fix doc * clean doc * fix docstring * fix tutorial * update fig * update explicit_hydrogen for its * prepare release * build doc * fix lint * fix bug in explicit hydrogen for ITS * fix build * fix * fix * fix * fix doc * update nauty canon, rule filters, change benchmark * prepare release * fix bug in nauty alg * update doc * add features for expanding its * add rule_matcher.py * add testcase rule matcher * add wildcard for smiles * add partial engine * update new features * update document * add data * update Chem features * format docstring and refractor Chem module * add auto-test pypi * create dependabot * test run yml * test * test docker * add docker * add docker * . * add readme * rename * release docker * remove redundant file * Prepare release bump version (#27) * update refractor * fix reactor * fix lint * prepare bechmark * refractor MODReactor and SynReactor * update crn * refractor cluster, change to matcher, fix code synreactor, now resnow comparable to modreactor * test 3 os * test * test * fix workflow * fix lint * fix win * fix win * fix win again * update smart * add synreactor implicit hydrogen * fix mcsmatcher * refractor visualization * fix conflict rdkit, upgrade to 2025.3.1 * fix lint * move aam_validator to Chem submodule * fix lint * prepare benchmark matcher * change backend rule to mod * prepare doc * add doc * update fih * update graph module doc * update doc * prepare release * . * fix doc * clean doc * fix docstring * fix tutorial * update fig * update explicit_hydrogen for its * prepare release * build doc * fix lint * fix bug in explicit hydrogen for ITS * fix build * fix * fix * fix * fix doc * update nauty canon, rule filters, change benchmark * prepare release * fix bug in nauty alg * update doc * add features for expanding its * add rule_matcher.py * add testcase rule matcher * add wildcard for smiles * add partial engine * update new features * update document * add data * update Chem features * format docstring and refractor Chem module * add auto-test pypi * create dependabot * test run yml * test * test docker * add docker * add docker * . * add readme * rename * release docker * remove redundant file * fix lint * fix bug * fix lint * add partial its beta * test publising conda * test publising conda * fix workflow * fix workflow * fix workflow * fix workflow again * tes pre-release * tes pre-release * tes pre-release * tes pre-release * tes pre-release * tes pre-release * fix meta.yaml * fix meta.yaml * fix meta.yaml * fix meta.yaml * fix meta.yaml * fix meta.yaml * publish beta * publish beta * debug * debug * debug * debug * debug * debug * debug * debug * prepare release * pass test staging, prepare release * quick fix hydrogen * prepare release * Prepare release (#30) * add partial its construction and imbaengine * add wildcard and placeholder * add testcase * add mtg * fix bug mtg * prepare release * Prepare release (#32) * add partial its construction and imbaengine * add wildcard and placeholder * add testcase * add mtg * fix bug mtg * prepare release * enhance ITSConstruction to capture hydrogen * add constraint for searching embedding * fix hydro * enhance batch reactor * add postprocess * fix cycle import and add data example * fix package contain data
TieuLongPhan
added a commit
that referenced
this pull request
Aug 6, 2025
* Refractor (#26) * update refractor * fix reactor * fix lint * prepare bechmark * refractor MODReactor and SynReactor * update crn * refractor cluster, change to matcher, fix code synreactor, now resnow comparable to modreactor * test 3 os * test * test * fix workflow * fix lint * fix win * fix win * fix win again * update smart * add synreactor implicit hydrogen * fix mcsmatcher * refractor visualization * fix conflict rdkit, upgrade to 2025.3.1 * fix lint * move aam_validator to Chem submodule * fix lint * prepare benchmark matcher * change backend rule to mod * prepare doc * add doc * update fih * update graph module doc * update doc * prepare release * . * fix doc * clean doc * fix docstring * fix tutorial * update fig * update explicit_hydrogen for its * prepare release * build doc * fix lint * fix bug in explicit hydrogen for ITS * fix build * fix * fix * fix * fix doc * update nauty canon, rule filters, change benchmark * prepare release * fix bug in nauty alg * update doc * add features for expanding its * add rule_matcher.py * add testcase rule matcher * add wildcard for smiles * add partial engine * update new features * update document * add data * update Chem features * format docstring and refractor Chem module * add auto-test pypi * create dependabot * test run yml * test * test docker * add docker * add docker * . * add readme * rename * release docker * remove redundant file * Prepare release bump version (#27) * update refractor * fix reactor * fix lint * prepare bechmark * refractor MODReactor and SynReactor * update crn * refractor cluster, change to matcher, fix code synreactor, now resnow comparable to modreactor * test 3 os * test * test * fix workflow * fix lint * fix win * fix win * fix win again * update smart * add synreactor implicit hydrogen * fix mcsmatcher * refractor visualization * fix conflict rdkit, upgrade to 2025.3.1 * fix lint * move aam_validator to Chem submodule * fix lint * prepare benchmark matcher * change backend rule to mod * prepare doc * add doc * update fih * update graph module doc * update doc * prepare release * . * fix doc * clean doc * fix docstring * fix tutorial * update fig * update explicit_hydrogen for its * prepare release * build doc * fix lint * fix bug in explicit hydrogen for ITS * fix build * fix * fix * fix * fix doc * update nauty canon, rule filters, change benchmark * prepare release * fix bug in nauty alg * update doc * add features for expanding its * add rule_matcher.py * add testcase rule matcher * add wildcard for smiles * add partial engine * update new features * update document * add data * update Chem features * format docstring and refractor Chem module * add auto-test pypi * create dependabot * test run yml * test * test docker * add docker * add docker * . * add readme * rename * release docker * remove redundant file * fix lint * fix bug * fix lint * add partial its beta * test publising conda * test publising conda * fix workflow * fix workflow * fix workflow * fix workflow again * tes pre-release * tes pre-release * tes pre-release * tes pre-release * tes pre-release * tes pre-release * fix meta.yaml * fix meta.yaml * fix meta.yaml * fix meta.yaml * fix meta.yaml * fix meta.yaml * publish beta * publish beta * debug * debug * debug * debug * debug * debug * debug * debug * prepare release * pass test staging, prepare release * quick fix hydrogen * prepare release * Prepare release (#30) * add partial its construction and imbaengine * add wildcard and placeholder * add testcase * add mtg * fix bug mtg * prepare release * Prepare release (#32) * add partial its construction and imbaengine * add wildcard and placeholder * add testcase * add mtg * fix bug mtg * prepare release * enhance ITSConstruction to capture hydrogen * add constraint for searching embedding * fix hydro * enhance batch reactor * add postprocess * fix cycle import and add data example * fix package contain data * fix bug release * fix bug release
TieuLongPhan
added a commit
that referenced
this pull request
Aug 22, 2025
* Refractor (#26) * update refractor * fix reactor * fix lint * prepare bechmark * refractor MODReactor and SynReactor * update crn * refractor cluster, change to matcher, fix code synreactor, now resnow comparable to modreactor * test 3 os * test * test * fix workflow * fix lint * fix win * fix win * fix win again * update smart * add synreactor implicit hydrogen * fix mcsmatcher * refractor visualization * fix conflict rdkit, upgrade to 2025.3.1 * fix lint * move aam_validator to Chem submodule * fix lint * prepare benchmark matcher * change backend rule to mod * prepare doc * add doc * update fih * update graph module doc * update doc * prepare release * . * fix doc * clean doc * fix docstring * fix tutorial * update fig * update explicit_hydrogen for its * prepare release * build doc * fix lint * fix bug in explicit hydrogen for ITS * fix build * fix * fix * fix * fix doc * update nauty canon, rule filters, change benchmark * prepare release * fix bug in nauty alg * update doc * add features for expanding its * add rule_matcher.py * add testcase rule matcher * add wildcard for smiles * add partial engine * update new features * update document * add data * update Chem features * format docstring and refractor Chem module * add auto-test pypi * create dependabot * test run yml * test * test docker * add docker * add docker * . * add readme * rename * release docker * remove redundant file * Prepare release bump version (#27) * update refractor * fix reactor * fix lint * prepare bechmark * refractor MODReactor and SynReactor * update crn * refractor cluster, change to matcher, fix code synreactor, now resnow comparable to modreactor * test 3 os * test * test * fix workflow * fix lint * fix win * fix win * fix win again * update smart * add synreactor implicit hydrogen * fix mcsmatcher * refractor visualization * fix conflict rdkit, upgrade to 2025.3.1 * fix lint * move aam_validator to Chem submodule * fix lint * prepare benchmark matcher * change backend rule to mod * prepare doc * add doc * update fih * update graph module doc * update doc * prepare release * . * fix doc * clean doc * fix docstring * fix tutorial * update fig * update explicit_hydrogen for its * prepare release * build doc * fix lint * fix bug in explicit hydrogen for ITS * fix build * fix * fix * fix * fix doc * update nauty canon, rule filters, change benchmark * prepare release * fix bug in nauty alg * update doc * add features for expanding its * add rule_matcher.py * add testcase rule matcher * add wildcard for smiles * add partial engine * update new features * update document * add data * update Chem features * format docstring and refractor Chem module * add auto-test pypi * create dependabot * test run yml * test * test docker * add docker * add docker * . * add readme * rename * release docker * remove redundant file * fix lint * fix bug * fix lint * add partial its beta * test publising conda * test publising conda * fix workflow * fix workflow * fix workflow * fix workflow again * tes pre-release * tes pre-release * tes pre-release * tes pre-release * tes pre-release * tes pre-release * fix meta.yaml * fix meta.yaml * fix meta.yaml * fix meta.yaml * fix meta.yaml * fix meta.yaml * publish beta * publish beta * debug * debug * debug * debug * debug * debug * debug * debug * prepare release * pass test staging, prepare release * quick fix hydrogen * prepare release * Prepare release (#30) * add partial its construction and imbaengine * add wildcard and placeholder * add testcase * add mtg * fix bug mtg * prepare release * Prepare release (#32) * add partial its construction and imbaengine * add wildcard and placeholder * add testcase * add mtg * fix bug mtg * prepare release * enhance ITSConstruction to capture hydrogen * add constraint for searching embedding * fix hydro * enhance batch reactor * add postprocess * fix cycle import and add data example * fix package contain data * fix bug release * fix bug release * Prepare Publication (#37) * test context graph application and automorphism * prepare for publication * pass test, preparing for packaging
TieuLongPhan
added a commit
that referenced
this pull request
Aug 22, 2025
* Refractor (#26) * update refractor * fix reactor * fix lint * prepare bechmark * refractor MODReactor and SynReactor * update crn * refractor cluster, change to matcher, fix code synreactor, now resnow comparable to modreactor * test 3 os * test * test * fix workflow * fix lint * fix win * fix win * fix win again * update smart * add synreactor implicit hydrogen * fix mcsmatcher * refractor visualization * fix conflict rdkit, upgrade to 2025.3.1 * fix lint * move aam_validator to Chem submodule * fix lint * prepare benchmark matcher * change backend rule to mod * prepare doc * add doc * update fih * update graph module doc * update doc * prepare release * . * fix doc * clean doc * fix docstring * fix tutorial * update fig * update explicit_hydrogen for its * prepare release * build doc * fix lint * fix bug in explicit hydrogen for ITS * fix build * fix * fix * fix * fix doc * update nauty canon, rule filters, change benchmark * prepare release * fix bug in nauty alg * update doc * add features for expanding its * add rule_matcher.py * add testcase rule matcher * add wildcard for smiles * add partial engine * update new features * update document * add data * update Chem features * format docstring and refractor Chem module * add auto-test pypi * create dependabot * test run yml * test * test docker * add docker * add docker * . * add readme * rename * release docker * remove redundant file * Prepare release bump version (#27) * update refractor * fix reactor * fix lint * prepare bechmark * refractor MODReactor and SynReactor * update crn * refractor cluster, change to matcher, fix code synreactor, now resnow comparable to modreactor * test 3 os * test * test * fix workflow * fix lint * fix win * fix win * fix win again * update smart * add synreactor implicit hydrogen * fix mcsmatcher * refractor visualization * fix conflict rdkit, upgrade to 2025.3.1 * fix lint * move aam_validator to Chem submodule * fix lint * prepare benchmark matcher * change backend rule to mod * prepare doc * add doc * update fih * update graph module doc * update doc * prepare release * . * fix doc * clean doc * fix docstring * fix tutorial * update fig * update explicit_hydrogen for its * prepare release * build doc * fix lint * fix bug in explicit hydrogen for ITS * fix build * fix * fix * fix * fix doc * update nauty canon, rule filters, change benchmark * prepare release * fix bug in nauty alg * update doc * add features for expanding its * add rule_matcher.py * add testcase rule matcher * add wildcard for smiles * add partial engine * update new features * update document * add data * update Chem features * format docstring and refractor Chem module * add auto-test pypi * create dependabot * test run yml * test * test docker * add docker * add docker * . * add readme * rename * release docker * remove redundant file * fix lint * fix bug * fix lint * add partial its beta * test publising conda * test publising conda * fix workflow * fix workflow * fix workflow * fix workflow again * tes pre-release * tes pre-release * tes pre-release * tes pre-release * tes pre-release * tes pre-release * fix meta.yaml * fix meta.yaml * fix meta.yaml * fix meta.yaml * fix meta.yaml * fix meta.yaml * publish beta * publish beta * debug * debug * debug * debug * debug * debug * debug * debug * prepare release * pass test staging, prepare release * quick fix hydrogen * prepare release * Prepare release (#30) * add partial its construction and imbaengine * add wildcard and placeholder * add testcase * add mtg * fix bug mtg * prepare release * Prepare release (#32) * add partial its construction and imbaengine * add wildcard and placeholder * add testcase * add mtg * fix bug mtg * prepare release * enhance ITSConstruction to capture hydrogen * add constraint for searching embedding * fix hydro * enhance batch reactor * add postprocess * fix cycle import and add data example * fix package contain data * fix bug release * fix bug release * Prepare Publication (#37) * test context graph application and automorphism * prepare for publication * pass test, preparing for packaging * bump version
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Prepare release