What are the tools used for structural bioinformatics?

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What are the tools used for structural bioinformatics?

Some of the tools used for structural bioinformatics include:

1. Molecular modeling software: These tools are used to build three-dimensional models of biomolecules based on their known or predicted structures. Examples include PyMOL, Chimera, and MODELLER.

2. Protein structure prediction tools: These tools use computational algorithms to predict the three-dimensional structure of proteins based on their amino acid sequence. Examples include I-TASSER, Rosetta, and Phyre2.

3. Molecular dynamics simulation software: These tools simulate the movement and interactions of atoms and molecules over time, allowing researchers to study the dynamics and behavior of biomolecules. Examples include GROMACS, NAMD, and AMBER.

4. Protein structure visualization tools: These tools are used to visualize and analyze protein structures, allowing researchers to study their features and interactions. Examples include VMD, UCSF Chimera, and PyMOL.

5. Protein structure comparison tools: These tools compare and align protein structures to identify similarities and differences, aiding in the study of protein evolution and function. Examples include DALI, CE, and TM-align.

6. Protein structure analysis tools: These tools analyze protein structures to predict their functional sites, identify ligand binding sites, and study their stability and dynamics. Examples include CASTp, ProSA-web, and STRIDE.

7. Protein structure databases: These databases store experimentally determined and predicted protein structures, providing a valuable resource for structural bioinformatics research. Examples include the Protein Data Bank (PDB), SCOP, and CATH.

These tools collectively aid in the analysis, prediction, and understanding of the three-dimensional structures of biomolecules, enabling insights into their functions and interactions.