This menu includes a set of chemistry field related settings:
The General settings include the Isotopic parent, the Positive charge and the Balanced charge setting.
The General Chemistry Settings |
The list of Salts and Solvates contained by the dictionary are displayed here. New salts/solvates can be added from here one by one and unused salts/solvates can be deleted. For uploading a list of salt and/or solvates use the Upload page.
The Salt and Solvate settings page |
On the Settings card, you can set the appearance of the Salt/Solvate panel, the rounding of the parent multiplicity, and the salt/solvate multiplicity fractional precision.
How to add a salt or solvate:
Add salt by drawing |
How to delete a salt or solvate:
From version 19.20.0-1910071220 it is possible to delete unused salts/solvates.
- Salts/solvates that are currently in use by the system cannot be deleted. A salt/solvate is considered to be used in the following cases:
- A salt/solvate is considered to be unused and can be deleted:
Click to the Delete selected button.
Delete unused salts |
The default general and parent Standardizer configurations |
The list of available standardizer actions is available here.
Two categories of structure checkers are found in the Registration system:
These checkers can run as warnings (in the "do_not_fix" mode) or, if available they can be set to fix the structural problems. You can find more details on the Structure Checker and Structure Fixer page.
The Quality Checkers and the Source-based Structure Checker settings page |
The default Stereo Analyzer Configuration (it will be improved) |