lithium0003 / jsme_ipywidget Goto Github PK

Hi,

I wrote a computer application with a tkinter gui. Can I intergrate this into my program so the user can draw his molecule and this will
return the smiles? Can I send smiles to this editor and change the groups in the editor and return the new molecule as smiles?

Thank you in advance.

Hi,

I'm trying to run your jupyter notebook on my server, but I keep getting the following error:

Failed to create view for 'SmilesView' from module 'smiles_widget' with model 'DOMWidgetModel' from module '@jupyter-widgets/base'
TypeError: Class constructor O cannot be invoked without 'new'
    at new i (INTERNALSERVERADDRESS/nbextensions/jupyter-js-widgets/extension.js?v=20230322101509:2:257463)
    at INTERNALSERVERADDRESS/nbextensions/jupyter-js-widgets/extension.js?v=20230322101509:2:742192

I think this might come from version mismatch of our jupyter-widget?

IPython          : 8.6.0
ipykernel        : 6.18.0
ipywidgets       : 8.0.2
jupyter_client   : 7.4.7
jupyter_core     : 5.0.0
jupyter_server   : 1.23.2
jupyterlab       : 3.5.0
nbclient         : 0.7.0
nbconvert        : 7.2.5
nbformat         : 5.7.0
notebook         : 6.5.2
qtconsole        : not installed
traitlets        : 5.5.0```

Thanks for any insigths on this, and it would be very helpful if you published your widget with cookiecutter!

Best,

Hugo

Hi,

Thanks for this useful tool,

I do not have java knowledge and I am wondering if it is possible to open the editor from another folder.

I thought it was enough by changing this;

require(['jsme/jsme.nocache.js']) by require(['/home/random/Desktop/JSME_ipywidget-master/jsme/jsme.nocache.js'])

However it does not do anything only shows the text SMILES: , but not the editor.

Does one always have to be cd in JSME_ipywidget folder to activate the editor?

Thanks!

Best regards,