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Revisions

  • Conformational Search: document the threaded, stoppable search The search now runs on a background thread with a progress bar, a Stop button that keeps the conformers already found, and a user-settable conformer count. Co-Authored-By: Claude Opus 5 <noreply@anthropic.com>

    @HiroYokoyama HiroYokoyama committed Aug 27, 2026
  • Add Camera Position Setter page; refresh three stale plugin pages Camera Position Setter had no wiki page despite being in the registry, which check_wiki_versions.py was flagging as absent from both catalogues. It now has a dedicated EN+JP walkthrough (ninth plugin to get one) covering standard views, numeric coordinates, orbital nudge, the global-vs-project bookmark split, and clipboard interchange with PyVista. The centering section documents which selection the plugin reads, since that is easy to get wrong: Center on Selected Atoms takes the 3D viewport selection and deliberately ignores the 2D sketch selection. v1.2.0 fixed a bug where it read the 2D selection only and so did nothing after a 3D pick, so the page says what to check if the button appears dead. Three pages had drifted behind the registry: - Job Manager 1.0.2 -> 1.1.3 gains a Chat alerts section. A webhook posts a finished job to Slack/Discord/Teams, since the notification worth having is for the overnight run nobody is sitting through. Documents the payload key differing by service, the http/https-only restriction, and the two deliberate asymmetries: the tick cannot be set before a room is configured, and saving a URL does not switch it on, though clearing one switches it off. - OPSIN 1.0.0 -> 1.0.1 and ORCA Result Analyzer 3.15.0 -> 3.15.4 are version stamps only. Verified there was nothing user-visible to write: OPSIN swapped add_plugin_menu for the host-registered run() entry point, leaving the menu location unchanged, and the ORCA releases only moved where the dialog opens, which the page never described. check_wiki_versions.py now reports only Group Template, whose source is ahead of the registry -- normal for an unreleased bump. Co-Authored-By: Claude Opus 5 <noreply@anthropic.com> Claude-Session: https://claude.ai/code/session_01FZgRtkr6UxHL25EFXiE6c9

    @HiroYokoyama HiroYokoyama committed Aug 26, 2026
  • Official Plugins: an empty value greys a key, it does not lock it A key with no value is no longer read-only in the Settings Saver editor. Say that it is greyed and skipped, and that typing a value brings it straight back. Co-Authored-By: Claude Opus 5 <noreply@anthropic.com>

    @HiroYokoyama HiroYokoyama committed Aug 22, 2026
  • Wiki page for OPSIN Name to Structure (v0.2.0) Catalogue entry plus a dedicated page in both languages: the JRE requirement up front, how to read the per-name failure reasons, and which option each one points at. Co-Authored-By: Claude Opus 5 <noreply@anthropic.com>

    @HiroYokoyama HiroYokoyama committed Aug 22, 2026
  • Official Plugins: Settings Saver now edits presets Describe the Edit... dialog in both catalogues: per-key values, rename, add/remove, and the tick that decides whether a key is applied on load or skipped so the current value survives. Note that a key with an empty value, or none at all, is skipped. Co-Authored-By: Claude Opus 5 <noreply@anthropic.com>

    @HiroYokoyama HiroYokoyama committed Aug 22, 2026
  • Catalogue Group Template (v1.0.0) Co-Authored-By: Claude Opus 5 <noreply@anthropic.com>

    @HiroYokoyama HiroYokoyama committed Aug 22, 2026
  • Add a dedicated Job Manager wiki page (EN + JP) Job Manager only had a catalogue-entry paragraph; it's grown enough -- four backends, the helper queue, the relay tag, batch drag-and-drop, sort and filter -- to warrant the same full-page treatment as the other six flagship plugins. Cross-linked from Home, the catalogue's flagship list, its summary-table row, and its See also section in both languages.

    @HiroYokoyama HiroYokoyama committed Aug 18, 2026
  • Document the Job Manager relay tag; bump Input Gen Pro footers ORCA Input Generator Pro v3.7.0 and Gaussian Input Generator Pro v1.4.0 both gained a configurable Job Manager relay tag ([prevfile:.xyz] / [prevfile:.chk]) with a Save as Default button; documented in both dialog sections and both language variants, footers bumped to match. The Job Manager catalogue entry now covers the relay feature (including the auto-chain-behind-an-unfinished-job behavior) and the batch drag-and-drop / sortable table added in v0.19.0, neither of which had reached the wiki yet.

    @HiroYokoyama HiroYokoyama committed Aug 18, 2026
  • Job Manager: submitting work that is already on the cluster The catalogue entry described the plugin as uploading an input file, which is no longer the only way it is used as of 0.9.0. Co-Authored-By: Claude Opus 5 <noreply@anthropic.com>

    @HiroYokoyama HiroYokoyama committed Aug 14, 2026
  • Drop Slab Builder's one-off Structure category, add plugin count Structure was used only by Slab Builder; every other entry in the catalogue categorizes under File/Analysis/DFT/Generator/Optimization/ Utility/Visualization/AI, so drop the outlier (matches the source and registry fix in moleditpy_slab_builder / moleditpy-plugins). Also added the total plugin count to the Summary table heading. Co-Authored-By: Claude Opus 5 <noreply@anthropic.com>

    @HiroYokoyama HiroYokoyama committed Aug 11, 2026
  • Catalogue the seven plugins that were only in the registry Job Manager, Slab Builder, the VASP / Quantum ESPRESSO / CP2K input generators, ORCA NICS Analyzer and Animated XYZ Giffer are all visible in plugins.json but had no wiki entry. The four periodic/solid-state plugins get their own section, since they share one design and feed each other CIFs. Co-Authored-By: Claude Opus 5 <noreply@anthropic.com>

    @HiroYokoyama HiroYokoyama committed Aug 11, 2026
  • Move version info from page headers to a footer note Version numbers at the top of a page read as current state and go stale silently. The six plugin guides now state, at the bottom, which version the page was written against and when; the catalogue drops its Version column entirely and points at REGISTRY/plugins.json for live versions. Co-Authored-By: Claude Opus 5 <noreply@anthropic.com>

    @HiroYokoyama HiroYokoyama committed Aug 11, 2026
  • Fix cross-wiki links: use full URLs for main-app-wiki pages Using Plugins, File Formats and Import/Export, and Tips for force-field selection in 3D optimization live in python_molecular_editor.wiki, not here. They were linked with relative ./Page-Name syntax, which resolves against this wiki and produced a 404 on GitHub. House style requires full https URLs for cross-wiki links; relative ./Page-Name is reserved for pages that actually live in this repo. Co-Authored-By: Claude Opus 5 <noreply@anthropic.com>

    @HiroYokoyama HiroYokoyama committed Aug 5, 2026
  • Remove ORCA NICS Analyzer coverage (unpublished, visible:false in registry) Deletes the summary-table row, dedicated section, and hidden-entry note in both the English and Japanese Official Plugins catalogue pages. NICS Placer (a different, visible plugin) is unaffected. Co-Authored-By: Claude Opus 5 <noreply@anthropic.com>

    @HiroYokoyama HiroYokoyama committed Aug 5, 2026
  • Move official plugin documentation here from the main app wiki Each project should carry its own reference: the plugin catalogue and the six per-plugin guides describe this repository's contents, not the editor, so they belong with the plugins. The main app wiki now links here instead, and keeps only Using Plugins, which is about the plugin system rather than any plugin. Co-Authored-By: Claude Opus 5 <noreply@anthropic.com>

    @HiroYokoyama HiroYokoyama committed Aug 5, 2026