diff options
Diffstat (limited to 'scripts/data.rb')
-rwxr-xr-x | scripts/data.rb | 9 |
1 files changed, 9 insertions, 0 deletions
diff --git a/scripts/data.rb b/scripts/data.rb index 72e6b28..d24e46b 100755 --- a/scripts/data.rb +++ b/scripts/data.rb @@ -6,6 +6,15 @@ data = {} data.merge!(YAML.load_file(File.join(dir,"summary.yaml"))) end +mut = {} +File.readlines("mutagenicity/mutagenicity.csv").each do |line| + smi, m = line.chomp.split(",") + mut[smi] ||= [] + mut[smi] << m +end + +data[:cv][:n_mult] = mut.select{|s,m| m.size > 1}.size + data[:cv][:n] = `cut -f1 -d ',' mutagenicity/mutagenicity.csv | wc -l`.chomp.to_i - 1 data[:cv][:n_uniq] = `cut -f1 -d ',' mutagenicity/mutagenicity.csv | sort -u | wc -l`.chomp.to_i - 1 |