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BALL--biochemical algorithms library 1.3.
Hildebrandt A, Dehof AK, Rurainski A, Bertsch A, Schumann M, Toussaint NC, Moll A, Stöckel D, Nickels S, Mueller SC, Lenhof HP, Kohlbacher O. Hildebrandt A, et al. Among authors: rurainski a. BMC Bioinformatics. 2010 Oct 25;11:531. doi: 10.1186/1471-2105-11-531. BMC Bioinformatics. 2010. PMID: 20973958 Free PMC article.
Automated bond order assignment as an optimization problem.
Dehof AK, Rurainski A, Bui QB, Böcker S, Lenhof HP, Hildebrandt A. Dehof AK, et al. Among authors: rurainski a. Bioinformatics. 2011 Mar 1;27(5):619-25. doi: 10.1093/bioinformatics/btq718. Epub 2011 Jan 17. Bioinformatics. 2011. PMID: 21245051