Custom DeepAutoQSAR Property Definition Dialog Box
Define a new property for optimization from an DeepAutoQSAR model for relevant data. The model must be fitted before you can define a property: this dialog box does not generate the model. Generate DeepAutoQSAR models using the DeepAutoQSAR Panel.
To open this dialog box, choose Define new DeepAutoQSAR property from the Property menu in the Optoelectronics Genetic Optimization Panel.
- Features
- Additional Resources
Custom DeepAutoQSAR Property Definition Dialog Box Features
- Name text box
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Specify the name to be used for the custom property. This name is used in the property menu in the Optoelectronics Genetic Optimization panel.
- Units text box
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Specify the units for the custom property (optional). These units are displayed in the main panel and used in the log file.
- DeepAutoQSAR model file text box and Browse button
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Enter the name of the DeepAutoQSAR model file that defines the custom property in the text box, or click Browse and navigate to the file. The file is an archive, with the default extension
.qzip. DeepAutoQSAR model files are created using the DeepAutoQSAR Panel. - Reset button
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Clear all data from the panel.