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When I use smiles to generate structs，i use this function:
Kekule.OpenBabel.enable(() => {
chemComposer.getEditor().setChemObjData('{"format": "smi", "data": "'+ smiles +'"}');
});
it will lo…
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## Steps to Reproduce
1. Go to demo site: http://partridgejiang.github.io/Kekule.js/demos/demoLauncher.html?id=chemEditor
2. Clear out the canvas to make it empty
3. Create the molecule:
![imag…
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Hi, We are trying to load rxn (reaction files) and v3000 files via the chem composer. the file is loading but the molecules are pushed to bottom left corner and garbled. do you now what could be the r…
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Any plan in supporting SVG output in the near future?
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Hi
Tried to insert a 3D model through moodle atto editor plugin. It inserts base64/png with black background. But the image is static and does not allow to rotate the image. Probably Three.js is not …
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Currently MMSchema does not handle multi-conformers (whereas OpenFF toolkit does). What is the best way to handle this disrepancy?
1 - Add another dimension to `Molecule.geometry` ? This would make…
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Hi there,
I might have found a small bug. When I use these smiles as input to load, let Kekule draw them and then output/save as a SMILE again, the SMILE-code changes:
`CC\C=C/CC` changes to `CC/C…
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I am working on a project with the Eshelman School of Pharmacy at UNC, and we were considering using your open-source Kekule.js(specifically the Chem Composer).
I want to find the location of the …
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When an electron pushing arrow is started on a lone pair, the arrow object is an Arc in the object inspector and in the exported JSON. I think it should be an ElectronPushingArrow. In addition it wo…
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If you customize the Chem Composer to only have some of the Style Tool Components, the manipulate and atom buttons start throwing errors in the console log. Using the manipulate button also causes wei…