jaqpot-algorithms

Java web services for NanoQSAR modelling. It uses wrappers on top of WEKA library and LIBSVM to train and test using algorithms such as Multi Linear Regression, PLS without VIP scores and Support Vector Machines. It also includes transformation algorithms like RBF, MOPAC descriptors calculation, scaling and standardization. Available at http://test.jaqpot.org:8080/jaqpot/swagger/#!/algorithm/