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Update contact-map.md
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structure/contact-map.md

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# Finding contacts within a protein chain: contact maps
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# Finding contacts between atoms in a protein: contact maps
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Contacts are a useful tool to analyse protein structures. It simplifies the 3-Dimensional view of the structures into a 2-Dimensional set of contacts between its atoms or its residues. The representation of the contacts in a matrix is known as the contact map. Many protein structure analysis and prediction efforts are done by using contacts, see for instance
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Contacts are a useful tool to analyse protein structures. They simplify the 3-Dimensional view of the structures into a 2-Dimensional set of contacts between its atoms or its residues. The representation of the contacts in a matrix is known as the contact map. Many protein structure analysis and prediction efforts are done by using contacts. For instance they can be useful for:
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+ development of structural alignment algorithms [Holm 1993][] [Caprara 2004][]
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+ automatic domain identification [Alexandrov 2003][] [Emmert-Streib 2007][]
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+ structural modelling by extraction of contact-based empirical potentials [Benkert 2008][]
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+ structure prediction via contact prediction from sequence information [Jones 2012][]
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## Getting the contact map of a protein chain
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Structure structure = StructureIO.getStructure("1SMT");
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AtomContactSet contacts = StructureTools.getAtomsInContact(structure.getChain(0), structure.getChain(1), 5, false);
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AtomContactSet contacts =
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StructureTools.getAtomsInContact(structure.getChain(0), structure.getChain(1), 5, false);
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System.out.println("Total number of atom contacts: "+contacts.size());
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```
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See [DemoContacts](https://github.com/biojava/biojava/blob/master/biojava3-structure/src/main/java/demo/DemoContacts.java) for a fully working demo of the example above.
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See [DemoContacts](https://github.com/biojava/biojava/blob/master/biojava3-structure/src/main/java/demo/DemoContacts.java) for a fully working demo of the examples above.
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[Holm 1993]: http://www.biomedcentral.com/pubmed/8377180
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[Caprara 2004]: http://www.biomedcentral.com/pubmed/15072687
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[Alexandrov 2003]: http://www.biomedcentral.com/pubmed/12584135
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[Emmert-Streib 2007]: http://www.biomedcentral.com/pubmed/17608939
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[Benkert 2008]: http://www.biomedcentral.com/pubmed/17932912
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[Jones 2012]: http://www.ncbi.nlm.nih.gov/pubmed/22101153

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