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Jupyter Notebook HTML Python
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This is a tool designed to provide a simple way of standardising molecules as a prelude to e.g. molecular modelling exercises. To install, download this project and ensure that Python can find the standardise/ directory. Note that RDKit must also be installed and accessible to Python. Please see the IPython Notebooks in docs/ or the HTML versions in docs/html/ for more information. The HTML version is also available for browsing at https://wwwdev.ebi.ac.uk/chembl/extra/francis/standardiser/. This work was funded by the IMI eTOX project. This code is released under the Apache 2.0 license. Copyright  is retained by the EMBL-EBI.