Adjustable chain trees for proteins

Research output: Contribution to journalJournal articleResearchpeer-review

A chain tree is a data structure for changing protein conformations. It enables very fast detection of clashes and free energy potential calculations. A modified version of chain trees that adjust themselves to the changing conformations of folding proteins is introduced. This results in much tighter bounding volume hierarchies and therefore fewer intersection checks. Computational results indicate that the efficiency of the adjustable chain trees is significantly improved compared to the traditional chain trees.
Original languageEnglish
JournalJournal of Computational Biology
Volume19
Issue number1
Pages (from-to)83-99
Number of pages17
ISSN1066-5277
DOIs
Publication statusPublished - 2012

ID: 33926272