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Create an app for lung issue to react according to the pharmaceutical drugs molecules it can test multiple drugs

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The app is built and ready. Download it here:

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What the app includes

Drug Input - 3 Methods

MethodHow it works
By NameType any drug name - matches internal DB instantly, or fetches live from PubChem for anything else
SMILES StringPaste any valid SMILES notation to render custom molecules
File UploadDrag-and-drop SDF, MOL, PDB, XYZ files

8 Pre-loaded Lung Drugs (full clinical data)

  • Salbutamol (β2-Agonist) - acute bronchodilator
  • Budesonide (Corticosteroid) - inhaled anti-inflammatory
  • Tiotropium (LAMA) - COPD maintenance
  • Montelukast (LTRA) - leukotriene antagonist
  • Theophylline (PDE inhibitor) - bronchodilator with narrow TI
  • Sildenafil (PDE5 inhibitor) - pulmonary arterial hypertension
  • Nintedanib (TKI) - IPF antifibrotic
  • Ivacaftor (CFTR modulator) - Cystic Fibrosis

Analysis Tabs (per drug)

  1. Overview - MW, half-life, bioavailability, mechanism of action, indications
  2. Lung Effects - quantified effect bars + interactive radar chart per lung compartment
  3. Receptors - binding targets with Ki values, selectivity, lung relevance
  4. Pathway - step-by-step signaling cascade with activation/inhibition visualization + effect timeline chart
  5. Compare - side-by-side table and multi-drug radar overlay for all queued drugs
  6. Side Effects - adverse reactions by severity (mild/moderate/severe) with mechanism

3D Viewer Features

  • Interactive rotate/zoom/pan
  • Style modes: Stick, Sphere, Cartoon, Surface, Line
  • Toggle auto-spin
  • Fullscreen mode
  • Jmol atom coloring (C=grey, O=red, N=blue, S=yellow, etc.)

Add All preload lung drugs

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Editing File
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