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Releases: MolarVerse/PQSetup

PQSetup 0.2.5

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@github-actions github-actions released this 06 Oct 14:06
97fe61f

Changes

  • Shared PQ terminal help and startup design.
  • Readiness, structure loading, perturbation, exports, errors and shutdown appear in concise logs.
  • Browser opening waits for a successful server startup; occupied ports produce a clear error.
  • Help, version and environment checks avoid scientific data processing imports.
  • PQDesign 0.1.3 is pinned and verified during builds.

CLI guide · Changes

PQSetup 0.2.4

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@github-actions github-actions released this 02 Oct 15:17
c0808b5

PQSetup 0.2.4 publishes the standalone PQDesign integration and a local-server startup fix.

Changes

  • Consume the versioned @molarverse/pq-design 0.1.2 archive from PQDesign, with its shared controls, styles, tokens, and license notice.
  • Reject unusable server ports before application startup.
  • Correct the nonfinite-coordinate regression input so it tests the intended validation behavior.

Validation

232 Python tests and 42 frontend tests passed. CI passed on Linux and macOS; strict docs, frontend build, and package checks passed. Desktop browser checks covered short landscape, portrait, and ultrawide layouts, NPT validation, and the complete four-file run-package download.

Tests requiring a locally installed PQ executable remain skipped; preparation and package validation were checked without claiming a simulation run.

Full changelog: v0.2.3...v0.2.4

PQSetup 0.2.3

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@github-actions github-actions released this 28 Sep 13:30
5b8fab4

What's Changed

  • Fix shared design runtime and release PQSetup 0.2.3 by @galjos in #32

Full Changelog: v0.2.2...v0.2.3

PQSetup 0.2.2

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@github-actions github-actions released this 28 Sep 13:15
ced831b

Superseded by PQSetup v0.2.3. The v0.2.2 browser interface can fail to render with React is not defined. Install v0.2.3.

What's Changed

  • Simplify generated inputs and separate validation from rendering by @galjos in #29
  • Restore generated input presentation by @galjos in #30
  • Prepare PQSetup 0.2.2 and shared design package by @galjos in #31

Full Changelog: v0.2.1...v0.2.2

PQ design 0.1.1

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@github-actions github-actions released this 28 Sep 13:26
5b8fab4

Versioned flat-mono tokens, CSS and React primitives for PQSetup, PQViewer and PQEnalyzer Web.

This archive remains available for existing lockfiles. New source changes and releases are in MolarVerse/PQDesign; use v0.1.2 for new installations.

PQ design 0.1.0

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@github-actions github-actions released this 28 Sep 13:08
ced831b

Superseded by PQ design 0.1.1. The 0.1.0 React controls can fail to render with React is not defined. Update the archive URL and lockfile to 0.1.1.

Versioned flat-mono tokens, CSS and React primitives for PQSetup, PQViewer and PQEnalyzer Web.

PQSetup 0.1.0

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@github-actions github-actions released this 13 Sep 09:00

What's Changed

  • Add PQSetup documentation site by @galjos in #1
  • Update PQSetup for PQ 0.7 by @galjos in #2
  • fix: reject '.' and '..' as setup filenames by @galjos in #10
  • fix: require rpmd_n_replica for qm-rpmd setups by @galjos in #9
  • fix: reject mm-opt with MD ensembles by @galjos in #7
  • fix: reject start_file equal to restart_file on simple export by @galjos in #8
  • Fix PyPI publishing for Core Metadata 2.5 by @galjos in #22

Full Changelog: https://github.com/MolarVerse/PQSetup/commits/v0.1.0