Open uneven2307 opened 3 months ago
Input
Establishing the ML/DL model input using SMILES of the targeted protein. SMILES can be expressed as a list of descriptors (in my study, I chose Lipinski Descriptors).
Output
The activity level is measured via the pIC50 value.
You can use this project as the following:
How should i use this model to evaluate active or inactive molecules using smiles?