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Modules
Nanoparticle
Step 1 · Platform Manipulations
Model Generation is required before downstream steps.
Model Generation
Model Simulation and Analysis
Step 2 · Drugs or Excipients
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Input SMILES
Upload File
SMILES
Choose files (e.g., .pdb, .mol2)
Number
Electrical Charge
Note:
Please add hydrogen atoms and define the charge for your molecule before submission!
Add New Drug or Excipients
Step 3 · Model Conditions
Box Size X (nm)
Box Size Y (nm)
Box Size Z (nm)
High Temperature (K)
Low Temperature (K)
Process
Note: Model generation ~1–2 minutes. Model simulation > 10 minutes (depends on system size).
MUST READ before process:
You may need multiple generation rounds to get an ideal model.
Do not
run simulation/analysis until the model looks good. Contact: um.formulationmm@gmail.com