HTS navigator: freely accessible cheminformatics software for analyzing high-throughput screening data

Denis Fourches, Maria F. Sassano, Bryan L. Roth, Alexander Tropsha
2013 Computer applications in the biosciences : CABIOS  
We report on the development of the high-throughput screening (HTS) Navigator software to analyze and visualize the results of HTS of chemical libraries. The HTS Navigator processes output files from different plate readers' formats, computes the overall HTS matrix, automatically detects hits and has different types of baseline navigation and correction features. The software incorporates advanced cheminformatics capabilities such as chemical structure storage and visualization, fast similarity
more » ... search and chemical neighborhood analysis for retrieved hits. The software is freely available for academic laboratories.
doi:10.1093/bioinformatics/btt718 pmid:24376084 pmcid:PMC3928525 fatcat:hm3bxz5ug5a45gusenroj5hr7m