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require File.join(File.dirname(__FILE__),'dataset.rb')
helpers do
def find
# + charges are dropped
uri = uri(params[:splat].first.gsub(/(InChI.*) (.*)/,'\1+\2')) # reinsert dropped '+' signs in InChIs
halt 404, "Dataset \"#{uri}\" not found." unless @set = Dataset.find(uri)
end
def uri(name)
name = URI.encode(name)
uri = File.join Dataset.base_uri, name
end
end
get '/tanimoto/dataset/*/dataset/*/?' do
find
@set.tanimoto(uri(params[:splat][1]))
end
get '/weighted_tanimoto/dataset/*/dataset/*/?' do
find
@set.weighted_tanimoto(uri(params[:splat][1]))
end
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