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To be able to perform mass predictions, mass list should have been upload in the Load mass list menu.
Not impemented. Ignore this box.
Not impemented. Ignore this box.
Use the Select atoms button to check one or multiple atoms to use for the prediction. Available atoms and their respective mass correspond to the mass list uploaded in the Load mass list menu.
The text box Enter a mass allow the user to write a mass to be used for the formula prediction.
Adjust the mass tolerance to consider for the formula prediction using the Enter a tolerance button.
Be careful, a larger mass tolerance result in a longer computation time. Consider using a small mass tolerance for your prediction.
Resulting predictions are displayed in this table.
The element/atom column allow the user to filter the formula based on the number of atom to in the resulting predictions : use the two-sided sliders to restrict the number of atoms to a thinner window of atom number.
mass_delta corresponds to the mass difference between the predicted formula and the input mass used for prediction.
Use the show menu to inscrease the number of lines displayed in the view.
You can copy to clipboard or save the table using the Copy, CSV, Excel or PDF buttons.