Your molecules should be uploaded in a comma-separated values, or CSV, file containing two columns:
- A UserID column, which will let you refer from the landscape to your work
- A SMILES column, which contains a SMILES string of the structure referenced by the UserID in the first column
For DesignView to work properly, your CSV file needs to be formatted properly:
- It should only contain the two columns, and the headers should read “UserID” and “Smiles” exactly
- The alphanumeric ID of each molecule should be the same character length. This will ensure that the content appears in the same order in the UserID filter
- Numbering in the UserID column should be two digits, not one. For example, use “-01,” not “-1”
- The Smiles string should have no spaces
- Any entries in your CSV file without a UserID or a Smiles string or have a non-translatable Smiles string, will not be uploaded
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