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| Tool | Primary FCMP Role | Key Strength | Key Limitation | | :--- | :--- | :--- | :--- | | | Prediction | Unprecedented accuracy for single-chain structures | Poor performance on conformational flexibility, large complexes | | DALI | Comparison | Gold standard for structural homology detection | Slower than hashing-based methods (e.g., Foldseek) | | MODELLER | Modeling | User control, handles multimeric proteins | Requires good template alignment; slower than deep learning | | Rosetta | All four | Most versatile; enables protein design | Steep learning curve; computationally intensive | | GROMACS | Folding | Atomic detail, kinetic information | Extremely compute-intensive; not for routine prediction |
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: Deep ergonomic fins serve as handholds, making it easy to tumble the drum even when it is heavy or nearly full. | Tool | Primary FCMP Role | Key