Molecule Input
Quick Examples
Example 1
Example 2
Example 3
Usage Instructions
📝 Input Format
• Single Molecule:
CN1C=NC2=C1C(=O)N(C(=O)N2C)C
• Multiple Molecules:
>Example1|SMILES
>Example2|SMILES
>Example3|SMILES
>Example2|SMILES
>Example3|SMILES
Format: >ID|SMILES (one per line)
🎯 Permeability Levels
High:
≥ -5.0
Medium:
-6.0 to -5.0
Low:
< -6.0
💡 Quick Tips
• Click examples to auto-fill
• Textarea is resizable
• Batch: max 100 molecules
• Textarea is resizable
• Batch: max 100 molecules
Model: Enhanced GAT
Task: Membrane permeability prediction
Task: Membrane permeability prediction
Enter SMILES to view structure
Waiting for Input
Enter molecular SMILES on the left and click "Start Prediction". The AI model will analyze membrane permeability.