Quorumpeps Molecule
Quorumpeps®
Download optimized .hin file.
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The geometry optimization was obtained by the molecular mechanics force field method, using the Polak–Ribière conjugate gradient algorithm with a rootmean-square (RMS) gradient of 0.1 kcal/ (Å×mol) as stop criterion using the Hyperchem Professional 8.0 software (Hypercube, Gainesville, FL, USA). The structure can be rotated by dragging the structure; zooming is possible by scrolling on it.
LDW(Geranyl)KY
| Quorumpeps moleculeID | 65 |
| SMILES | O=C(O)C(Cc1ccc(O)cc1)NC(=O)C(CCCCN)NC(=O)C2CC3(C\C=C(/C)CC\C=C(/C)C)c4ccccc4NC3N2C(=O)C(CC(=O)O)NC(=O)C(N)CC(C)C |
| Molecular formula | C46H65N7O9 |
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