package hts_shrink
Install
Dune Dependency
Authors
Maintainers
Sources
sha256=88cb3bd595ef1bc148625b3295433c75d028fdd8f99de8e25e18e00e561f7734
md5=47250c8677294cbd70f9d3e60d02b04b
Description
Reference implementation of the Distance-Based Boolean Applicability Domain (DBBAD). For more information, and if you use the software, please cite: "A Distance-Based Boolean Applicability Domain for Classification of High Throughput Screening Data" Francois Berenger and Yoshihiro Yamanishi. Journal of Chemical Information and Modeling: https://pubs.acs.org/doi/10.1021/acs.jcim.8b00499
Published: 29 Jan 2019
README
hts_shrink
Distance-Based Boolean Applicability Domain for Classification of High Throughput Screening Data
Reference implementation of the Distance-Based Boolean Applicability Domain.
For more information, and if you use the software, please cite:
"A Distance-Based Boolean Applicability Domain for Classification of High Throughput Screening Data". Francois Berenger and Yoshihiro Yamanishi. Journal of Chemical Information and Modeling: https://pubs.acs.org/doi/10.1021/acs.jcim.8b00499
To install the software
opam update
opam install hts_shrink
To test the software
./test.sh
For an example, plese look into test.sh.