mdtraj — Easy Playground

Molecular dynamics trajectory analysis

Getting started with mdtrajRun locally

Install

pip install mdtraj

Python CodeRun locally

# Install: pip install mdtraj
import mdtraj

# Basic mdtraj usage
print(f"Using mdtraj")
# See documentation for detailed examples

# Install: pip install mdtraj
import mdtraj

# Basic mdtraj usage
print(f"Using mdtraj")
# See documentation for detailed examples

Expected Output

# Expected output shown below
# (Run locally with: mdtraj)

mdtraj is a third-party package. Molecular dynamics trajectory analysis. Install with: pip install mdtraj

Try modifying the code above to explore different behaviors. Can you extend the example to handle a new use case?