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| Original file line number | Diff line number | Diff line change |
|---|---|---|
| @@ -0,0 +1,148 @@ | ||
| <!DOCTYPE html> | ||
| <html lang="en"> | ||
| <head> | ||
| <meta charset="UTF-8"> | ||
| <meta name="viewport" content="width=device-width, initial-scale=1.0"> | ||
| <title>3D Molecule Viewer</title> | ||
| <style> | ||
| body { | ||
| font-family: -apple-system, BlinkMacSystemFont, 'Segoe UI', Roboto, sans-serif; | ||
| max-width: 800px; | ||
| margin: 0 auto; | ||
| padding: 20px; | ||
| background-color: #f5f5f5; | ||
| } | ||
| .container { | ||
| background: white; | ||
| padding: 20px; | ||
| border-radius: 8px; | ||
| box-shadow: 0 2px 4px rgba(0,0,0,0.1); | ||
| } | ||
| h1 { | ||
| color: #333; | ||
| margin-bottom: 10px; | ||
| } | ||
| .description { | ||
| color: #666; | ||
| margin-bottom: 20px; | ||
| } | ||
| .form-group { | ||
| margin-bottom: 20px; | ||
| } | ||
| label { | ||
| display: block; | ||
| margin-bottom: 5px; | ||
| font-weight: 500; | ||
| } | ||
| input[type="text"] { | ||
| width: 100%; | ||
| padding: 8px; | ||
| border: 1px solid #ddd; | ||
| border-radius: 4px; | ||
| box-sizing: border-box; | ||
| font-size: 16px; | ||
| } | ||
| button { | ||
| background-color: #4CAF50; | ||
| color: white; | ||
| padding: 10px 20px; | ||
| border: none; | ||
| border-radius: 4px; | ||
| cursor: pointer; | ||
| font-size: 16px; | ||
| width: 100%; | ||
| } | ||
| button:hover { | ||
| background-color: #45a049; | ||
| } | ||
| #viewer { | ||
| width: 100%; | ||
| height: 400px; | ||
| background-color: #f8f8f8; | ||
| border: 1px solid #ddd; | ||
| border-radius: 4px; | ||
| margin-top: 20px; | ||
| display: flex; | ||
| align-items: center; | ||
| justify-content: center; | ||
| color: #666; | ||
| } | ||
| .error { | ||
| color: #d32f2f; | ||
| background-color: #ffebee; | ||
| padding: 10px; | ||
| border-radius: 4px; | ||
| margin-top: 10px; | ||
| display: none; | ||
| } | ||
| .instructions { | ||
| margin-top: 20px; | ||
| padding: 15px; | ||
| background-color: #f5f5f5; | ||
| border-radius: 4px; | ||
| } | ||
| .instructions h3 { | ||
| margin-top: 0; | ||
| } | ||
| .instructions ol { | ||
| margin: 0; | ||
| padding-left: 20px; | ||
| } | ||
| .instructions li { | ||
| margin-bottom: 8px; | ||
| } | ||
| </style> | ||
| </head> | ||
| <body> | ||
| <div class="container"> | ||
| <h1>3D Molecule Viewer</h1> | ||
| <p class="description">Enter a SMILES string to generate a 3D molecular structure</p> | ||
|
|
||
| <form id="moleculeForm"> | ||
| <div class="form-group"> | ||
| <label for="smiles">SMILES String:</label> | ||
| <input type="text" | ||
| id="smiles" | ||
| name="smiles" | ||
| placeholder="e.g., CC(=O)O for acetic acid" | ||
| required> | ||
| </div> | ||
| <button type="submit">Generate 3D Structure</button> | ||
| </form> | ||
|
|
||
| <div id="error" class="error"> | ||
| Error message will appear here | ||
| </div> | ||
|
|
||
| <div id="viewer"> | ||
| 3D visualization will appear here | ||
| </div> | ||
|
|
||
| <div class="instructions"> | ||
| <h3>Implementation Guide</h3> | ||
| <ol> | ||
| <li>Set up a backend service that can convert SMILES to 3D coordinates (using RDKit or OpenBabel)</li> | ||
| <li>Add a molecular visualization library like 3Dmol.js or NGL Viewer</li> | ||
| <li>Update the form submission handler to call your backend API</li> | ||
| <li>Initialize the 3D viewer with the returned coordinates</li> | ||
| </ol> | ||
| </div> | ||
| </div> | ||
|
|
||
| <script> | ||
| document.getElementById('moleculeForm').addEventListener('submit', function(e) { | ||
| e.preventDefault(); | ||
|
|
||
| const smilesInput = document.getElementById('smiles').value; | ||
| const errorDiv = document.getElementById('error'); | ||
|
|
||
| // This is where you would typically make an API call | ||
| // For demo purposes, we'll just show an error message | ||
| errorDiv.style.display = 'block'; | ||
| errorDiv.textContent = 'Note: This is a demo form. To make it functional, you need to:' + | ||
| '\n1. Add a backend service that converts SMILES to 3D coordinates' + | ||
| '\n2. Integrate a 3D visualization library like 3Dmol.js or NGL'; | ||
| }); | ||
| </script> | ||
| </body> | ||
| </html> |