# [QtDraw](https://cmt-mu.github.io/QtDraw/)
3D drawing tool for molecules and crystals based on [PyVista](https://docs.pyvista.org/) and [Qt](https://www.riverbankcomputing.com/static/Docs/PyQt5/#).
Drawings are associated with crystallographic symmetry operations provided by [MultiPie](https://github.com/CMT-MU/MultiPie).
- **Authors**: Hiroaki Kusunose
- **Citing QtDraw and MultiPie**: If you are using QtDraw and/or MultiPie in your scientific research, please help our scientific visibility by citing our work:
> Hiroaki Kusunose, Rikuto Oiwa, and Satoru Hayami, Symmetry-adapted modeling for molecules and crystals, Phys. Rev. B <b>107</b>, 195118 (2023).<br>
> DOI: [https://doi.org/10.1103/PhysRevB.107.195118](https://doi.org/10.1103/PhysRevB.107.195118)
- **Installation**: QtDraw can be installed from PyPI using pip on Python >= 3.9:
```
pip install qtdraw
```
- It is useful to associate with the following application with `.qtdw` and `.cif` extension.
- [Mac](https://github.com/CMT-MU/QtDraw/tree/main/others/QtDraw_MacApp.zip)
- [Windows](https://github.com/CMT-MU/QtDraw/tree/main/others/QtDraw_WinApp.zip)
- You can also visit [PyPI](https://pypi.org/project/qtdraw/) or [GitHub](https://github.com/CMT-MU/QtDraw) to download the source.
- See also, [Install Guide (in Japanese)](./src/install_guide.pdf)
- Shell command `qtdraw [filename]` is available.
- **Requirements**:
- This library requires [TeXLive](https://www.tug.org/texlive/) environment.
- Symmetry operation supports are provided by [MultiPie](https://github.com/CMT-MU/MultiPie).
- **See also**:
- [Manual (QtDraw and MultiPie)](https://github.com/CMT-MU/QtDraw/blob/main/docs/manual.pdf).
- [MyST syntax cheat sheet](https://jupyterbook.org/en/stable/reference/cheatsheet.html)
- [MultiPie tutorial (in Japanese)](https://cmt-mu.github.io/MultiPieTutorial/)
- [QtDraw tutorial (in Japanese)](https://cmt-mu.github.io/QtDrawTutorial/)
Raw data
{
"_id": null,
"home_page": "",
"name": "qtdraw",
"maintainer": "",
"docs_url": null,
"requires_python": ">=3.9",
"maintainer_email": "",
"keywords": "group theory,condensed matter,materials science,symmetry-adapted basis,pyvista,qtpy5",
"author": "",
"author_email": "Hiroaki Kusunose <hiroaki.kusunose@gmail.com>",
"download_url": "https://files.pythonhosted.org/packages/53/4f/18ee10d50a6ecc2d7ba8b8dd199e7258c1b0aef992808a741ddb16ee7122/qtdraw-1.1.30.tar.gz",
"platform": null,
"description": "# [QtDraw](https://cmt-mu.github.io/QtDraw/)\n\n3D drawing tool for molecules and crystals based on [PyVista](https://docs.pyvista.org/) and [Qt](https://www.riverbankcomputing.com/static/Docs/PyQt5/#).\nDrawings are associated with crystallographic symmetry operations provided by [MultiPie](https://github.com/CMT-MU/MultiPie).\n\n- **Authors**: Hiroaki Kusunose\n\n- **Citing QtDraw and MultiPie**: If you are using QtDraw and/or MultiPie in your scientific research, please help our scientific visibility by citing our work:\n > Hiroaki Kusunose, Rikuto Oiwa, and Satoru Hayami, Symmetry-adapted modeling for molecules and crystals, Phys. Rev. B <b>107</b>, 195118 (2023).<br>\n > DOI: [https://doi.org/10.1103/PhysRevB.107.195118](https://doi.org/10.1103/PhysRevB.107.195118)\n\n- **Installation**: QtDraw can be installed from PyPI using pip on Python >= 3.9:\n ```\n pip install qtdraw\n ```\n - It is useful to associate with the following application with `.qtdw` and `.cif` extension.\n - [Mac](https://github.com/CMT-MU/QtDraw/tree/main/others/QtDraw_MacApp.zip)\n - [Windows](https://github.com/CMT-MU/QtDraw/tree/main/others/QtDraw_WinApp.zip)\n - You can also visit [PyPI](https://pypi.org/project/qtdraw/) or [GitHub](https://github.com/CMT-MU/QtDraw) to download the source.\n - See also, [Install Guide (in Japanese)](./src/install_guide.pdf)\n - Shell command `qtdraw [filename]` is available.\n\n- **Requirements**:\n - This library requires [TeXLive](https://www.tug.org/texlive/) environment.\n - Symmetry operation supports are provided by [MultiPie](https://github.com/CMT-MU/MultiPie).\n\n- **See also**:\n - [Manual (QtDraw and MultiPie)](https://github.com/CMT-MU/QtDraw/blob/main/docs/manual.pdf).\n - [MyST syntax cheat sheet](https://jupyterbook.org/en/stable/reference/cheatsheet.html)\n - [MultiPie tutorial (in Japanese)](https://cmt-mu.github.io/MultiPieTutorial/)\n - [QtDraw tutorial (in Japanese)](https://cmt-mu.github.io/QtDrawTutorial/)\n",
"bugtrack_url": null,
"license": "MIT",
"summary": "3D drawing tool for molecules and crystals based on Pyvista and Qt.",
"version": "1.1.30",
"project_urls": {
"Homepage": "https://github.com/CMT-MU/QtDraw",
"Issues": "https://github.com/CMT-MU/QtDraw/issues"
},
"split_keywords": [
"group theory",
"condensed matter",
"materials science",
"symmetry-adapted basis",
"pyvista",
"qtpy5"
],
"urls": [
{
"comment_text": "",
"digests": {
"blake2b_256": "8515a8e54bfb11ff8608fbe6ce83f9b4e2e626890c0139dbfa157018212f87b7",
"md5": "71acea106982248fd79710f0b753ef8e",
"sha256": "3c054fa3fa0b16f6ef687007c59173781aeb749c57cfea3748c41fcfcb38d022"
},
"downloads": -1,
"filename": "qtdraw-1.1.30-py3-none-any.whl",
"has_sig": false,
"md5_digest": "71acea106982248fd79710f0b753ef8e",
"packagetype": "bdist_wheel",
"python_version": "py3",
"requires_python": ">=3.9",
"size": 270405,
"upload_time": "2024-02-10T04:20:48",
"upload_time_iso_8601": "2024-02-10T04:20:48.160690Z",
"url": "https://files.pythonhosted.org/packages/85/15/a8e54bfb11ff8608fbe6ce83f9b4e2e626890c0139dbfa157018212f87b7/qtdraw-1.1.30-py3-none-any.whl",
"yanked": false,
"yanked_reason": null
},
{
"comment_text": "",
"digests": {
"blake2b_256": "534f18ee10d50a6ecc2d7ba8b8dd199e7258c1b0aef992808a741ddb16ee7122",
"md5": "7705589fde43dbcd4fdbad6348b025d6",
"sha256": "370aff16bad35c1f3baaed2ec7bd7a55e6a40dc62c8e080c2b20e640f4b9b5ec"
},
"downloads": -1,
"filename": "qtdraw-1.1.30.tar.gz",
"has_sig": false,
"md5_digest": "7705589fde43dbcd4fdbad6348b025d6",
"packagetype": "sdist",
"python_version": "source",
"requires_python": ">=3.9",
"size": 264247,
"upload_time": "2024-02-10T04:20:50",
"upload_time_iso_8601": "2024-02-10T04:20:50.304850Z",
"url": "https://files.pythonhosted.org/packages/53/4f/18ee10d50a6ecc2d7ba8b8dd199e7258c1b0aef992808a741ddb16ee7122/qtdraw-1.1.30.tar.gz",
"yanked": false,
"yanked_reason": null
}
],
"upload_time": "2024-02-10 04:20:50",
"github": true,
"gitlab": false,
"bitbucket": false,
"codeberg": false,
"github_user": "CMT-MU",
"github_project": "QtDraw",
"travis_ci": false,
"coveralls": false,
"github_actions": false,
"lcname": "qtdraw"
}
JSON
