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base repository: ccdc-opensource/csd-python-api-scripts
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base: restructure
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head repository: ccdc-opensource/csd-python-api-scripts
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compare: main
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  • 18 commits
  • 18 files changed
  • 6 contributors

Commits on Jun 19, 2026

  1. ci(NO_JIRA): Updated .github/workflows/lint-python.yml

    @ccdc-github-admin
    ccdc-github-admin committed Jun 19, 2026
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  2. ci(NO_JIRA): Updated .github/workflows/lint-markdown.yml

    @ccdc-github-admin
    ccdc-github-admin committed Jun 19, 2026
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  3. ci(NO_JIRA): Updated .github/workflows/common_ccdc_status_checks.yml

    @ccdc-github-admin
    ccdc-github-admin committed Jun 19, 2026
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  4. ci(NO_JIRA): Updated .github/workflows/lint-dockerfiles.yml

    @ccdc-github-admin
    ccdc-github-admin committed Jun 19, 2026
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  5. ci(NO_JIRA): Updated .github/workflows/lint-yaml.yml

    @ccdc-github-admin
    ccdc-github-admin committed Jun 19, 2026
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Commits on Jun 24, 2026

  1. Merge pull request #94 from ccdc-opensource/restructure 

    Move files to new locations and update descriptions so they're easier…
    @CRingroseCCDC
    CRingroseCCDC authored Jun 24, 2026
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  2. ci(NO_JIRA): Updated .yamllint.yml

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    ccdc-github-admin committed Jun 24, 2026
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Commits on Jun 29, 2026

  1. Add disorder-aware CIF export demo

    @SchrodingersCattt
    SchrodingersCattt committed Jun 29, 2026
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  2. Refactor disorder export demo for Sonar

    @SchrodingersCattt
    SchrodingersCattt committed Jun 29, 2026
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  3. Sanitize CLI inputs to address S8707 path injection rule 

    - Validate refcode with strict alphanumeric regex before use as filename
- Validate output-dir: reject path traversal (..), enforce cwd-relative
- Break taint chain: CLI args no longer flow directly to filesystem ops
    @SchrodingersCattt
    SchrodingersCattt committed Jun 29, 2026
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Commits on Jul 10, 2026

  1. took out the License print statement NO_JIRA

    @IsaacSugden
    IsaacSugden committed Jul 10, 2026
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  2. Merge pull request #96 from SchrodingersCattt/add-disorder-workflow-demo 

    feat: add disorder-aware CIF export demo
    @IsaacSugden
    IsaacSugden authored Jul 10, 2026
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Commits on Aug 3, 2026

  1. NO_JIRA Added Pharmacophore generator script to create CrossMiner que… 

    …ries from Ligand Overlay outputs. Includes basic tests and examples.
    @CRingroseCCDC
    CRingroseCCDC committed Aug 3, 2026
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  2. ci(NO_JIRA): Updated .github/workflows/lint-python.yml

    @ccdc-github-admin
    ccdc-github-admin committed Aug 3, 2026
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  3. ci(NO_JIRA): Updated .github/workflows/common_ccdc_status_checks.yml

    @ccdc-github-admin
    ccdc-github-admin committed Aug 3, 2026
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Commits on Aug 7, 2026

  1. NO_JIRA Added Pharmacophore generator script to create CrossMiner que… 

    …ries from Ligand Overlay outputs. Includes basic tests and examples.
    @CRingroseCCDC
    CRingroseCCDC committed Aug 7, 2026
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  2. NO_JIRA Added Pharmacophore generator script to create CrossMiner que… 

    …ries from Ligand Overlay outputs. Includes basic tests and examples.
    @CRingroseCCDC
    CRingroseCCDC committed Aug 7, 2026
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  3. Merge pull request #99 from ccdc-opensource/pharmacophore_generator 

    NO_JIRA Added Pharmacophore generator script to create CrossMiner que…
    @CRingroseCCDC
    CRingroseCCDC authored Aug 7, 2026
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