Update Getting Started

README.md

@@ -138,37 +138,66 @@ make -j$(nproc)
 sudo make install
 ```
 
-## Quick Start
+## Getting Started
 
-### Web GUI (Recommended!)
+### Installation
 
 ```bash
+# Clone repository
+git clone https://huggingface.co/OpenPeerAI/DockingAtHOME
+cd DockingAtHOME
+
 # Install dependencies
 pip install -r requirements.txt
+npm install
 
-# Start the GUI server
-python start.py
+# Build C++/CUDA components
+mkdir build && cd build
+cmake .. && make -j$(nproc)
+```
+
+### Quick Start with GUI
 
-# Open browser to: http://localhost:8080
+```bash
+# Start the web-based GUI (fastest way to get started)
+docking-at-home gui
+
+# Or with Python
+python -m docking_at_home.gui
+
+# Open browser to http://localhost:8080
 ```
 
-The GUI provides:
-- 🖱️ **Drag-and-drop** file upload
-- 📊 **Real-time** progress monitoring
-- 📈 **Live statistics** dashboard
-- 🎯 **Interactive** job management
-- 📱 **Responsive** design
+### Quick Start Example (CLI)
+
+```python
+from docking_at_home import DockingClient
 
-### Command Line
+# Initialize client (localhost mode)
+client = DockingClient(mode="localhost")
 
-```bash
-# Run docking from terminal
-docking-at-home dock -l molecule.pdbqt -r protein.pdbqt
+# Submit docking job
+job = client.submit_job(
+    ligand="path/to/ligand.pdbqt",
+    receptor="path/to/receptor.pdbqt",
+    num_runs=100
+)
+
+# Monitor progress
+status = client.get_status(job.id)
 
+# Retrieve results
+results = client.get_results(job.id)
+print(f"Best binding energy: {results.best_energy} kcal/mol")
+```
+
+### Running on Localhost
+
+```bash
 # Start server
 docking-at-home server --port 8080
 
-# Start worker
+# In another terminal, run worker
 docking-at-home worker --local
 ```
 
@@ -199,16 +228,6 @@ async def main():
 asyncio.run(main())
 ```
 
-### Running on Localhost
-
-```bash
-# Start the local server
-docking-at-home server --port 8080
-
-# In another terminal, run the worker
-docking-at-home worker --local
-```
-
 ## Configuration
 
 Configuration files are located in `config/`: