PyPI - ipyvasp - Versions diffs - 0.9.96__tar.gz → 0.9.98__tar.gz - Mend

ipyvasp 0.9.96tar.gz → 0.9.98tar.gz

This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.

Files changed (30) hide show

{ipyvasp-0.9.96 → ipyvasp-0.9.98}/PKG-INFO RENAMED Viewed

@@ -1,6 +1,6 @@
 Metadata-Version: 2.1
 Name: ipyvasp
-Version: 0.9.96
+Version: 0.9.98
 Summary: A processing tool for VASP DFT input/output processing in Jupyter Notebook.
 Home-page: https://github.com/massgh/ipyvasp
 Author: Abdul Saboor
@@ -24,6 +24,7 @@ Requires-Dist: plotly==6.0.1
 Requires-Dist: requests==2.28.1
 Requires-Dist: typer==0.9.0
 Requires-Dist: einteract
+Requires-Dist: sympy
 Provides-Extra: extra
 Requires-Dist: jupyterlab>=3.5.2; extra == "extra"
 Requires-Dist: ipython>=8.7; extra == "extra"
@@ -34,6 +35,7 @@ Requires-Dist: nglview>=3.0.4; extra == "extra"
 # IPyVASP
 [![DOI](https://zenodo.org/badge/DOI/10.5281/zenodo.15482350.svg)](https://doi.org/10.5281/zenodo.15482350)
+[![Binder](https://mybinder.org/badge_logo.svg)](https://mybinder.org/v2/gh/asaboor-gh/ipyvasp/HEAD?urlpath=%2Fdoc%2Ftree%2Fdocs%2Fsource%2Fnotebooks%2Fquickstart.ipynb)
 [![PyPI Downloads](https://static.pepy.tech/badge/ipyvasp)](https://pepy.tech/projects/ipyvasp)
 An VASP-based DFT pre and post processing tool.
@@ -81,4 +83,4 @@ Apply operations on POSCAR and simultaneously view using plotly's `FigureWidget`
 ![snip](op.png)
 ![BandsWidget](Bands.jpg)
-More coming soon!
+More coming soon! You can test these examples on [![Binder](https://mybinder.org/badge_logo.svg)](https://mybinder.org/v2/gh/asaboor-gh/ipyvasp/HEAD?urlpath=%2Fdoc%2Ftree%2Fdocs%2Fsource%2Fnotebooks%2Fquickstart.ipynb).

{ipyvasp-0.9.96 → ipyvasp-0.9.98}/README.md RENAMED Viewed

@@ -1,6 +1,7 @@
 # IPyVASP
 [![DOI](https://zenodo.org/badge/DOI/10.5281/zenodo.15482350.svg)](https://doi.org/10.5281/zenodo.15482350)
+[![Binder](https://mybinder.org/badge_logo.svg)](https://mybinder.org/v2/gh/asaboor-gh/ipyvasp/HEAD?urlpath=%2Fdoc%2Ftree%2Fdocs%2Fsource%2Fnotebooks%2Fquickstart.ipynb)
 [![PyPI Downloads](https://static.pepy.tech/badge/ipyvasp)](https://pepy.tech/projects/ipyvasp)
 An VASP-based DFT pre and post processing tool.
@@ -48,4 +49,4 @@ Apply operations on POSCAR and simultaneously view using plotly's `FigureWidget`
 ![snip](op.png)
 ![BandsWidget](Bands.jpg)
-More coming soon!
+More coming soon! You can test these examples on [![Binder](https://mybinder.org/badge_logo.svg)](https://mybinder.org/v2/gh/asaboor-gh/ipyvasp/HEAD?urlpath=%2Fdoc%2Ftree%2Fdocs%2Fsource%2Fnotebooks%2Fquickstart.ipynb).

ipyvasp-0.9.98/ipyvasp/_version.py ADDED Viewed

	@@ -0,0 +1 @@
1	+ __version__ = "0.9.98"

{ipyvasp-0.9.96 → ipyvasp-0.9.98}/ipyvasp/utils.py RENAMED Viewed

@@ -137,6 +137,19 @@ def _sig_kwargs(from_func, skip_params=()):
     return wrapper
+def _md_code_blocks_to_rst(text):
+    def repl(match):
+        language = match.group(1) or 'python'  # default to 'python' if no language
+        code = match.group(2)
+        return f'.. code-block:: {language}\n\n   ' + '\n   '.join(code.strip().splitlines())
+    return re.sub(
+        r'```([a-zA-Z0-9]*)\s*\n(.*?)```',
+        repl,
+        text,
+        flags=re.DOTALL
+    )
 def _sub_doc(from_func, replace={}):
     """Assing __doc__ from other function. Replace words in docs where need."""
@@ -148,7 +161,7 @@ def _sub_doc(from_func, replace={}):
         for k, v in replace.items():
             docs = re.sub(k, v, docs, count=1, flags=re.DOTALL)
-        func.__doc__ = docs
+        func.__doc__ = _md_code_blocks_to_rst(docs)
         return func
     return wrapper

{ipyvasp-0.9.96 → ipyvasp-0.9.98}/ipyvasp/widgets.py RENAMED Viewed

@@ -87,13 +87,6 @@ def summarize(files, func, **kwargs):
     )
-_progress_svg = """<svg xmlns="http://www.w3.org/2000/svg" height="5em" viewBox="0 0 50 50">
-    <path fill="skyblue" d="M25,5A20.14,20.14,0,0,1,45,22.88a2.51,2.51,0,0,0,2.49,2.26h0A2.52,2.52,0,0,0,50,22.33a25.14,25.14,0,0,0-50,0,2.52,2.52,0,0,0,2.5,2.81h0A2.51,2.51,0,0,0,5,22.88,20.14,20.14,0,0,1,25,5Z">
-        <animateTransform attributeName="transform" type="rotate" from="0 25 25" to="360 25 25" dur="0.2s" repeatCount="indefinite"/>
-    </path>
-</svg>"""
 def fix_signature(cls):
     # VBox ruins signature of subclass, let's fix it
     cls.__signature__ = inspect.signature(cls.__init__)
@@ -598,7 +591,7 @@ class _ThemedFigureInteract(ei.InteractBase):
         self.observe(self._autosize_figs, names = 'isfullscreen') # fix figurewidget problem
     def _autosize_figs(self, change):
-        for w in self._all_widgets.values():
+        for w in self.params:
             # don't know yet about these without importing
             if re.search('plotly.*FigureWidget', str(type(w).__mro__)):
                 w.layout.autosize = False # Double trigger is important
@@ -798,7 +791,7 @@ class BandsWidget(_ThemedFigureInteract):
     @ei.callback
     def _toggle_footer(self, showft):
-        self._app.pane_heights = [0,100 - showft, showft]
+        self.pane_heights = [0,100 - showft, showft]
     @ei.callback
     def _set_krange(self, krange):

{ipyvasp-0.9.96 → ipyvasp-0.9.98}/ipyvasp.egg-info/PKG-INFO RENAMED Viewed

@@ -1,6 +1,6 @@
 Metadata-Version: 2.1
 Name: ipyvasp
-Version: 0.9.96
+Version: 0.9.98
 Summary: A processing tool for VASP DFT input/output processing in Jupyter Notebook.
 Home-page: https://github.com/massgh/ipyvasp
 Author: Abdul Saboor
@@ -24,6 +24,7 @@ Requires-Dist: plotly==6.0.1
 Requires-Dist: requests==2.28.1
 Requires-Dist: typer==0.9.0
 Requires-Dist: einteract
+Requires-Dist: sympy
 Provides-Extra: extra
 Requires-Dist: jupyterlab>=3.5.2; extra == "extra"
 Requires-Dist: ipython>=8.7; extra == "extra"
@@ -34,6 +35,7 @@ Requires-Dist: nglview>=3.0.4; extra == "extra"
 # IPyVASP
 [![DOI](https://zenodo.org/badge/DOI/10.5281/zenodo.15482350.svg)](https://doi.org/10.5281/zenodo.15482350)
+[![Binder](https://mybinder.org/badge_logo.svg)](https://mybinder.org/v2/gh/asaboor-gh/ipyvasp/HEAD?urlpath=%2Fdoc%2Ftree%2Fdocs%2Fsource%2Fnotebooks%2Fquickstart.ipynb)
 [![PyPI Downloads](https://static.pepy.tech/badge/ipyvasp)](https://pepy.tech/projects/ipyvasp)
 An VASP-based DFT pre and post processing tool.
@@ -81,4 +83,4 @@ Apply operations on POSCAR and simultaneously view using plotly's `FigureWidget`
 ![snip](op.png)
 ![BandsWidget](Bands.jpg)
-More coming soon!
+More coming soon! You can test these examples on [![Binder](https://mybinder.org/badge_logo.svg)](https://mybinder.org/v2/gh/asaboor-gh/ipyvasp/HEAD?urlpath=%2Fdoc%2Ftree%2Fdocs%2Fsource%2Fnotebooks%2Fquickstart.ipynb).

{ipyvasp-0.9.96 → ipyvasp-0.9.98}/ipyvasp.egg-info/requires.txt RENAMED Viewed

@@ -8,6 +8,7 @@ plotly==6.0.1
 requests==2.28.1
 typer==0.9.0
 einteract
+sympy
 [extra]
 jupyterlab>=3.5.2

{ipyvasp-0.9.96 → ipyvasp-0.9.98}/setup.py RENAMED Viewed

@@ -29,6 +29,7 @@ REQUIRED = [
     "requests==2.28.1",
     "typer==0.9.0",
     "einteract", # any latest version of einteract
+    "sympy",
 ]
 # What packages are optional?