module OpenTox class Nanoparticle < Substance include OpenTox field :core, type: Hash, default: {} field :coating, type: Array, default: [] def add_feature feature, value, dataset unless feature.name == "ATOMIC COMPOSITION" or feature.name == "FUNCTIONAL GROUP" # redundand case feature.category when "P-CHEM" properties[feature.id.to_s] ||= [] properties[feature.id.to_s] << value properties[feature.id.to_s].uniq! when "Proteomics" properties[feature.id.to_s] ||= [] properties[feature.id.to_s] << value properties[feature.id.to_s].uniq! when "TOX" dataset.add self, feature, value else warn "Unknown feature type '#{feature.category}'. Value '#{value}' not inserted." end dataset_ids << dataset.id dataset_ids.uniq! end end def parse_ambit_value feature, v, dataset # TODO add study id to warnings v.delete "unit" # TODO: ppm instead of weights if v.keys == ["textValue"] add_feature feature, v["textValue"], dataset elsif v.keys == ["loValue"] add_feature feature, v["loValue"], dataset elsif v.keys.size == 2 and v["errorValue"] add_feature feature, v["loValue"], dataset warn "Ignoring errorValue '#{v["errorValue"]}' for '#{feature.name}'." elsif v.keys.size == 2 and v["loQualifier"] == "mean" add_feature feature, v["loValue"], dataset warn "'#{feature.name}' is a mean value. Original data is not available." elsif v.keys.size == 2 and v["loQualifier"] #== ">=" warn "Only min value available for '#{feature.name}', entry ignored" elsif v.keys.size == 2 and v["upQualifier"] #== ">=" warn "Only max value available for '#{feature.name}', entry ignored" elsif v.keys.size == 3 and v["loValue"] and v["loQualifier"].nil? and v["upQualifier"].nil? add_feature feature, v["loValue"], dataset warn "loQualifier and upQualifier are empty." elsif v.keys.size == 3 and v["loValue"] and v["loQualifier"] == "" and v["upQualifier"] == "" add_feature feature, v["loValue"], dataset warn "loQualifier and upQualifier are empty." elsif v.keys.size == 4 and v["loValue"] and v["loQualifier"].nil? and v["upQualifier"].nil? add_feature feature, v["loValue"], dataset warn "loQualifier and upQualifier are empty." elsif v.size == 4 and v["loQualifier"] and v["upQualifier"] and v["loValue"] and v["upValue"] add_feature feature, [v["loValue"],v["upValue"]].mean, dataset warn "Using mean value of range #{v["loValue"]} - #{v["upValue"]} for '#{feature.name}'. Original data is not available." elsif v.size == 4 and v["loQualifier"] == "mean" and v["errorValue"] warn "'#{feature.name}' is a mean value. Original data is not available. Ignoring errorValue '#{v["errorValue"]}' for '#{feature.name}'." add_feature feature, v["loValue"], dataset elsif v == {} # do nothing else warn "Cannot parse Ambit eNanoMapper value '#{v}' for feature '#{feature.name}'." end end end end