Snapshots and Input/Output files

SAMPLE INPUT and OUTPUT Files

Input File

Same format for all three modules

First Row: Header names, i.e., name for each column, for instances, ‘Chemical ID’, ‘chemical name’, ‘descriptor names’, etc.

First column: Chemical ID or serial number (data can be numerical/alpha-numericals/alphabets )

Second column: Chemical Name (data can be numerical/alpha-numericals/alphabets )

Subsequent columns: Descriptors values (data can be numerical values only)

InputFile_DR.xlsx

PROPERTY PREDICTOR MODULE

Output Files

DETAIL REPORT (.txt file)

Sample_DetailReport_CytoTox.txt

SUMMARY REPORT (.csv file)

Sample_SummaryReport_CytoTox.csv

READ ACROSS REPORT (.csv file)

Sample_Read-Across_CytoTox.csv

Screener Module

OUTPUT FILE

Sample screening results for 9900 ionic liquids against Vibrio Fischeri toxicity

SCREENING REPORT (.csv file)

Sample_ScreeningReport_EcoTox.csv

Fate Predictor module

Graphs and Output files

FATE ASSESSMENT REPORT (.txt file)

Sample_FatePredictorResults.txt

FATE ASSESSMENT REPORT FOR ANALYSIS (.csv file)

Sample_FatePredictorResults.csv