|
| 1 | +## CatGo 1.4.12 |
| 2 | + |
| 3 | +CatGo 1.4.12 is a cross-platform reliability release for CatBot, scientific |
| 4 | +workflows, large trajectories, and the integrated terminal. It includes the |
| 5 | +unpublished 1.4.10 and 1.4.11 improvements, plus release-time fixes verified on |
| 6 | +the Windows, macOS Apple Silicon, and Linux packaged build paths. |
| 7 | + |
| 8 | +### Highlights |
| 9 | + |
| 10 | +- **CatBot works from installed desktop packages** — Claude, Codex, and Gemini |
| 11 | + CLI discovery follows platform-native user paths, while the bundled backend |
| 12 | + and Agent Bridge expose the same Provider, MCP, Skills, voice, structure, |
| 13 | + workflow, and Campaign capabilities as the source build. |
| 14 | +- **Packaged backends start with a coherent native runtime** — Linux bundles |
| 15 | + one ABI-compatible conda C++ runtime, and Windows Campaign cold starts are |
| 16 | + validated with reliable full-process-tree cleanup. |
| 17 | +- **Attachments reach the selected model** — images, PDFs, text files, and |
| 18 | + general files are carried through SDK, direct-provider, and backend-relay |
| 19 | + paths instead of being silently discarded. |
| 20 | +- **Surface workflows are scientifically complete** — the clean slab is |
| 21 | + relaxed before adsorbate branches, frozen atoms stay consistent through |
| 22 | + geometry optimization and frequency calculations, and workflow status comes |
| 23 | + from actual task evidence. |
| 24 | +- **Large trajectories and terminals remain responsive and complete** — bounded |
| 25 | + frame caches reduce memory pressure, while terminal resizing preserves CJK |
| 26 | + cells and keeps the final column clear of the scrollbar. |
| 27 | + |
| 28 | +### Added |
| 29 | + |
| 30 | +#### Packaged CatBot verification |
| 31 | + |
| 32 | +- Added all-platform frozen-backend smoke tests covering the Provider catalogue, |
| 33 | + native voice health, bundled core Skills, all 21 CatGo MCP tools, structure and |
| 34 | + pane access, workflows, and real REST/MCP Campaign creation. |
| 35 | +- Added compiled Agent Bridge smoke tests for Claude, Codex, and Gemini session, |
| 36 | + attachment, permission, failure, and stream-completion paths. |
| 37 | +- Added native attachment transport for Claude image/PDF blocks, Codex local |
| 38 | + images, Gemini ACP images, and safe temporary file access for other formats. |
| 39 | +- Added a release boundary that publishes the VS Code extension to Marketplace |
| 40 | + and Open VSX only after the exact-version Linux, macOS, and Windows sidecars |
| 41 | + and their SHA256 metadata are available on the public mirror. |
| 42 | + |
| 43 | +#### CatBot and Codex integration |
| 44 | + |
| 45 | +- Added live Codex model discovery so CatBot's provider label follows the |
| 46 | + installed CLI instead of carrying a stale hard-coded model version. |
| 47 | +- Preserved the user's Codex skills and MCP configuration while registering the |
| 48 | + desktop CatGo server under its own namespace. |
| 49 | +- Routed CatBot structure, workflow, and export actions through the active CatGo |
| 50 | + runtime connection rather than fixed localhost ports. |
| 51 | +- Added structure recovery for pop-out chat windows and viewer panels so closing |
| 52 | + a presentation window does not erase the underlying structure. |
| 53 | + |
| 54 | +#### Workflow management and surface science |
| 55 | + |
| 56 | +- Added safe bulk selection and deletion to project and workflow views, with |
| 57 | + durable success or failure feedback. |
| 58 | +- Added task-derived workflow state aggregation for CHECK, PAUSED, FAILED, |
| 59 | + REMOTE_ERROR, RUNNING, and completed work. |
| 60 | +- Added a clean-slab geometry-optimization node before adsorbate branches in |
| 61 | + generated surface workflows. |
| 62 | +- Persisted exact frozen-atom indices from slab generation through slab |
| 63 | + optimization, adsorbate geometry optimization, and adsorbate-only frequency |
| 64 | + calculations. |
| 65 | + |
| 66 | +### Fixed |
| 67 | + |
| 68 | +#### Cross-platform CatBot runtime |
| 69 | + |
| 70 | +- Fixed Linux frozen backends mixing Ubuntu 22.04's older `libstdc++` with |
| 71 | + conda ICU. PyInstaller now selects the conda `libstdc++`/`libgcc` pair and |
| 72 | + verifies that it provides every collected CXXABI and GLIBCXX version. |
| 73 | +- Fixed Windows packaged Campaign verification using a five-second generic API |
| 74 | + timeout for the first frozen invocation. The smoke test now gives Campaign a |
| 75 | + realistic cold-start budget and terminates the complete PyInstaller process |
| 76 | + tree before removing logs. |
| 77 | +- Fixed GUI-launched Windows and macOS apps failing to find user-installed |
| 78 | + Claude, Codex, or Gemini CLIs because desktop launchers supplied a reduced |
| 79 | + PATH. |
| 80 | +- Fixed installed Windows local terminals opening with the wrong shell or losing |
| 81 | + the selected shell and current directory across runtime transitions. |
| 82 | +- Fixed frozen desktop backends launching Campaign as `python -m catgo`, which |
| 83 | + recursively invoked the packaged executable instead of the CatGo CLI. |
| 84 | +- Fixed the first microphone action racing the delayed voice router and becoming |
| 85 | + stuck on an unavailable browser fallback. |
| 86 | +- Fixed CatBot attachments appearing in the composer but never reaching SDK, |
| 87 | + direct-provider, or backend-relay requests. |
| 88 | +- Fixed migrated tool-registry tests importing the obsolete pre-package module |
| 89 | + path, restoring coverage of packaged tool discovery. |
| 90 | +- Fixed official VS Code builds becoming visible before their matching server |
| 91 | + sidecars, which previously produced unrecoverable HTTP 404 downloads. |
| 92 | + |
| 93 | +#### Workflow correctness and recovery |
| 94 | + |
| 95 | +- Fixed workflows that were reported as generated but never appeared in the |
| 96 | + visible CatGo workspace. |
| 97 | +- Fixed completed, failed, or checking workflows that remained labeled RUNNING, |
| 98 | + while continuing to protect genuinely executing tasks and unresolved remote |
| 99 | + jobs from deletion. |
| 100 | +- Fixed slab and geometry-optimization previews showing different frozen layers |
| 101 | + despite sharing the same structure. |
| 102 | +- Fixed manual freeze edits that appeared selected but were not persisted into |
| 103 | + downstream inputs. |
| 104 | + |
| 105 | +#### Database and networking |
| 106 | + |
| 107 | +- Prevented Materials Project, OPTIMADE, and PubChem requests from inheriting |
| 108 | + agent-only SOCKS proxy settings. Normal HTTP proxy configuration remains |
| 109 | + available to the backend. |
| 110 | +- Improved OPTIMADE provider recovery so a failed upstream request is reported |
| 111 | + accurately instead of leaving database search unusable. |
| 112 | + |
| 113 | +#### Trajectory and terminal rendering |
| 114 | + |
| 115 | +- Synchronized typed trajectory positions with topology and bond snapshots in |
| 116 | + Large System Performance Mode. |
| 117 | +- Bounded decoded frame caches and refreshed bond snapshots without retaining an |
| 118 | + unbounded object graph during playback. |
| 119 | +- Reserved terminal columns beside the scrollbar so the right edge is visible. |
| 120 | +- Reflowed active full-screen terminal applications on font changes and repaired |
| 121 | + pre-existing tabs after hot reload, preventing CJK character loss. |
| 122 | + |
| 123 | +#### Citation |
| 124 | + |
| 125 | +- Updated the preferred CatGo citation to the published *Digital Discovery* |
| 126 | + article, DOI `10.1039/D6DD00273K`. |
| 127 | + |
| 128 | +### Upgrade notes |
| 129 | + |
| 130 | +- No project, workflow database, structure-file, or trajectory migration is |
| 131 | + required. |
| 132 | +- Existing Codex skills and MCP configuration are retained. CatGo's desktop MCP |
| 133 | + entry is isolated automatically; remove obsolete hand-written CatGo entries |
| 134 | + only if you previously added duplicates yourself. |
| 135 | +- Workflow deletion remains unavailable for tasks that are executing or whose |
| 136 | + remote job identity is unresolved. This is an intentional safety boundary. |
| 137 | +- Generated surface workflows contain a clean-slab relaxation node. Review slab |
| 138 | + constraints before submitting a newly generated DAG. |
| 139 | +- CatBot keeps attachment metadata in restored chat history but does not persist |
| 140 | + attachment bytes in browser storage. Reattach a file before asking a follow-up |
| 141 | + question that requires rereading it. |
| 142 | +- VS Code, Cursor, VSCodium, and Theia users should install the Marketplace or |
| 143 | + Open VSX build. A manually version-edited VSIX has no matching sidecar and is |
| 144 | + intentionally rejected instead of silently running a different backend. |
| 145 | + |
| 146 | +### Included pull requests |
| 147 | + |
| 148 | +- [#571](https://github.com/Hello-QM/catgo-LRG/pull/571) — Update the preferred |
| 149 | + citation to the published *Digital Discovery* article. |
| 150 | +- [#574](https://github.com/Hello-QM/catgo-LRG/pull/574) — Harden CatBot, |
| 151 | + workflow lifecycle and slab constraints, provider networking, large-system |
| 152 | + trajectories, and terminal resizing. |
| 153 | +- [#576](https://github.com/Hello-QM/catgo-LRG/pull/576) — Repair Windows local |
| 154 | + shells and working-directory synchronization, then harden the complete |
| 155 | + packaged CatBot runtime across supported desktop platforms. |
| 156 | + |
| 157 | +### Downloads |
| 158 | + |
| 159 | +- **Windows x86-64** — `.msi` or `-setup.exe` |
| 160 | +- **macOS Apple Silicon** — Developer-ID signed `.dmg` |
| 161 | +- **Linux x86-64** — `.deb` or `.rpm` |
| 162 | +- **Android** — `CatGo-v*-android-universal.apk` |
| 163 | +- **iOS** — [TestFlight beta](https://testflight.apple.com/join/FdHup5Hz) |
| 164 | +- **VS Code** — `.vsix` |
| 165 | +- **Headless/HPC** — platform sidecars and `catgo-hpc-bundle.tar.gz` |
| 166 | + |
| 167 | +### License and citation |
| 168 | + |
| 169 | +CatGo 1.4.12 distributions use **AGPL-3.0-or-later**. |
| 170 | + |
| 171 | +If CatGo contributes to your work, please include this acknowledgement and the |
| 172 | +preferred citation: |
| 173 | + |
| 174 | +> This work used CatGo (https://app.catgo-ucsd.org). |
| 175 | +
|
| 176 | +Please cite DOI |
| 177 | +[`10.1039/D6DD00273K`](https://doi.org/10.1039/D6DD00273K). |
| 178 | +This request is not an additional condition of the AGPL license. Third-party |
| 179 | +materials retain their own terms. Historical AGPL grants remain in effect. |
| 180 | + |
| 181 | +See the |
| 182 | +[CHANGELOG](https://github.com/Hello-QM/catgo-LRG/blob/main/CHANGELOG.md) |
| 183 | +for the complete release history. |
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