add jupyterlab as a main dependency

README.md

@@ -145,6 +145,8 @@ Test voila with
 voila optimade-client.ipynb
 ```
 
+If dependencies are updated, update `requirements.txt` file that is used for the Docker image used in binder. The command to update the file is included at the top of `requirements.txt`.
+
 ### Making a new release
 
 To create a new release, clone the repository, install development dependencies with `pip install -e '.[dev]'`, and then execute `bumpver update [--major|--minor|--patch] [--tag-num --tag [alpha|beta|rc]]`.

pyproject.toml

@@ -43,6 +43,7 @@ dependencies = [
   "requests~=2.31",
   "widget_periodictable~=4.1",
   "semver~=3.0",
+  "jupyterlab~=4.0",
 ]
 
 [project.optional-dependencies]
@@ -52,7 +53,6 @@ dev = [
   "pytest-cov~=4.1",
   "bumpver>=2023.1129",
   "pip-tools~=7.4",
-  "jupyterlab~=4.0",
 ]
 voila = ["voila~=0.4.0"]
 

requirements.txt

@@ -7,7 +7,9 @@
 annotated-types==0.6.0
     # via pydantic
 anyio==4.2.0
-    # via jupyter-server
+    # via
+    #   httpx
+    #   jupyter-server
 anywidget==0.9.11
     # via widget-periodictable
 appdirs==1.4.4
@@ -22,6 +24,8 @@ ase==3.22.1
     # via ipyoptimade (pyproject.toml)
 asttokens==2.4.1
     # via stack-data
+async-lru==2.0.4
+    # via jupyterlab
 attrs==23.2.0
     # via
     #   jsonschema
@@ -35,17 +39,24 @@ bleach==6.1.0
 cachecontrol[filecache]==0.13.1
     # via ipyoptimade (pyproject.toml)
 certifi==2023.11.17
-    # via requests
+    # via
+    #   httpcore
+    #   httpx
+    #   requests
 cffi==1.16.0
     # via argon2-cffi-bindings
 charset-normalizer==3.3.2
     # via requests
 comm==0.2.1
-    # via ipywidgets
+    # via
+    #   ipykernel
+    #   ipywidgets
 contourpy==1.2.0
     # via matplotlib
 cycler==0.12.1
     # via matplotlib
+debugpy==1.8.1
+    # via ipykernel
 decorator==5.1.1
     # via ipython
 defusedxml==0.7.1
@@ -68,21 +79,34 @@ fonttools==4.47.2
     # via matplotlib
 fqdn==1.5.1
     # via jsonschema
+h11==0.14.0
+    # via httpcore
+httpcore==1.0.5
+    # via httpx
+httpx==0.27.0
+    # via jupyterlab
 idna==3.6
     # via
     #   anyio
     #   email-validator
+    #   httpx
     #   jsonschema
     #   requests
 importlib-metadata==7.0.1
     # via
     #   jupyter-client
+    #   jupyter-lsp
+    #   jupyterlab
     #   jupyterlab-server
     #   nbconvert
 importlib-resources==6.1.1
     # via matplotlib
+ipykernel==6.29.4
+    # via jupyterlab
 ipython==8.18.1
-    # via ipywidgets
+    # via
+    #   ipykernel
+    #   ipywidgets
 ipywidgets==8.1.1
     # via
     #   anywidget
@@ -95,6 +119,7 @@ jedi==0.19.1
 jinja2==3.1.3
     # via
     #   jupyter-server
+    #   jupyterlab
     #   jupyterlab-server
     #   nbconvert
 json5==0.9.14
@@ -110,29 +135,41 @@ jsonschema-specifications==2023.12.1
     # via jsonschema
 jupyter-client==8.6.0
     # via
+    #   ipykernel
     #   jupyter-server
     #   nbclient
     #   voila
 jupyter-core==5.7.1
     # via
+    #   ipykernel
     #   jupyter-client
     #   jupyter-server
+    #   jupyterlab
     #   nbclient
     #   nbconvert
     #   nbformat
     #   voila
 jupyter-events==0.9.0
     # via jupyter-server
+jupyter-lsp==2.2.5
+    # via jupyterlab
 jupyter-server==2.12.5
     # via
+    #   jupyter-lsp
+    #   jupyterlab
     #   jupyterlab-server
+    #   notebook-shim
     #   voila
 jupyter-server-terminals==0.5.2
     # via jupyter-server
+jupyterlab==4.1.6
+    # via ipyoptimade (pyproject.toml)
 jupyterlab-pygments==0.3.0
     # via nbconvert
 jupyterlab-server==2.25.2
-    # via voila
+    # via
+    #   jupyterlab
+    #   voila
 jupyterlab-widgets==3.0.9
     # via
     #   ipywidgets
@@ -148,7 +185,9 @@ markupsafe==2.1.4
 matplotlib==3.8.2
     # via ase
 matplotlib-inline==0.1.6
-    # via ipython
+    # via
+    #   ipykernel
+    #   ipython
 mistune==3.0.2
     # via nbconvert
 msgpack==1.0.7
@@ -166,8 +205,12 @@ nbformat==5.9.2
     #   jupyter-server
     #   nbclient
     #   nbconvert
+nest-asyncio==1.6.0
+    # via ipykernel
 nglview==3.0.8
     # via ipyoptimade (pyproject.toml)
+notebook-shim==0.2.4
+    # via jupyterlab
 numpy==1.26.3
     # via
     #   ase
@@ -182,7 +225,9 @@ overrides==7.7.0
     # via jupyter-server
 packaging==23.2
     # via
+    #   ipykernel
     #   jupyter-server
+    #   jupyterlab
     #   jupyterlab-server
     #   matplotlib
     #   nbconvert
@@ -202,6 +247,8 @@ prometheus-client==0.19.0
     # via jupyter-server
 prompt-toolkit==3.0.43
     # via ipython
+psutil==6.0.0
+    # via ipykernel
 psygnal==0.11.1
     # via anywidget
 ptyprocess==0.7.0
@@ -242,6 +289,7 @@ pyyaml==6.0.1
     # via jupyter-events
 pyzmq==25.1.2
     # via
+    #   ipykernel
     #   jupyter-client
     #   jupyter-server
 referencing==0.33.0
@@ -280,7 +328,9 @@ six==1.16.0
     #   python-dateutil
     #   rfc3339-validator
 sniffio==1.3.0
-    # via anyio
+    # via
+    #   anyio
+    #   httpx
 soupsieve==2.5
     # via beautifulsoup4
 stack-data==0.6.3
@@ -291,20 +341,26 @@ terminado==0.18.0
     #   jupyter-server-terminals
 tinycss2==1.2.1
     # via nbconvert
+tomli==2.0.1
+    # via jupyterlab
 tornado==6.4
     # via
+    #   ipykernel
     #   jupyter-client
     #   jupyter-server
+    #   jupyterlab
     #   terminado
 traitlets==5.14.1
     # via
     #   comm
+    #   ipykernel
     #   ipython
     #   ipywidgets
     #   jupyter-client
     #   jupyter-core
     #   jupyter-events
     #   jupyter-server
+    #   jupyterlab
     #   matplotlib-inline
     #   nbclient
     #   nbconvert
@@ -316,6 +372,7 @@ typing-extensions==4.9.0
     # via
     #   anyio
     #   anywidget
+    #   async-lru
     #   ipython
     #   pydantic
     #   pydantic-core
@@ -325,7 +382,7 @@ uri-template==1.3.0
     # via jsonschema
 urllib3==2.2.0
     # via requests
-voila==0.5.6
+voila==0.4.4
     # via ipyoptimade (pyproject.toml)
 wcwidth==0.2.13
     # via prompt-toolkit