Quantitative global studies of reactomes and metabolomes using a vectorial representation of reactions and chemical compounds
1 Computational Systems Biology Group, National Centre for Biotechnology (CNB-CSIC), C/Darwin, 3, Cantoblanco, 28049 Madrid, Spain
2 Genomics Unit, National Centre for Biotechnology (CNB-CSIC), C/Darwin, 3, Cantoblanco, 28049 Madrid, Spain
BMC Systems Biology 2010, 4:46 doi:10.1186/1752-0509-4-46Published: 20 April 2010
Additional file 1:
Correlation between experimental and predicted molecular weight (MW) and total polar surface area (TPSA).
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Additional file 2:
UPGMA tree of reaction vectors, in newick format. This file can be viewed with most phylogenetic tree viewers, including the on-line tool iTol (http://itol.embl.de).
Format: NW Size: 34KB Download file
Additional file 3:
File with the information needed for coloring the tree "Add2_UPGMA.nw" in iTOL (itol.embl.de) according to EC number.
Format: TXT Size: 19KB Download file