Tutorial
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Last updated
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Search for molecules, either by entering search criteria in the search box:
or else apply filters using the box on the left:
3. Click "Search" button to show search results.
4. Clicking on a molecule ID will take you to the detail page. At the top of the page, a 3D molecular structure is shown, as well as basic properties like the point group, charge, and spin multiplicity:
5. In MPcules, properties may be calculated in different solvent environments. You can select which properties you want to see by selecting from the drop-down menu on the right:
