Node Connectivity

There are 3683 nodes that can be used as predessesor for a node with an input port of type Table.

Convert Matrix to Table 

Converts a binary Canvas Matrix into the output table

Convert Table to FingerPrint 

This node inputs a table consisting of binary or real-valued data columns and converts into canvas fingerprints.

Convert Table to Matrix 

This node inputs a table, which consists of a molecule name and a n-by-n matrix of double precision numbers, where n is the number of molecules.

Convert Bitvector to FingerPrint 

This node converts Bitvectors to FingerPrints.

Bayes Classification Model Building 

Build a Bayes model from binary or continuous training data to predict the probability of a molecule at each activity level.

Bayes Classification Prediction 

Test a previously built Bayes model

PLS Model Building 

Build a multiple linear regression model based on variables derived from a PLS (Partial Least-Squares) analysis of a selection of properties for a […]

PLS Prediction 

Test a previously built PLS (Partial Least-Squares) regression model

AutoQSAR Build Model 

Generate QSAR models for a chosen property of a set of compounds, and apply the QSAR model to other compounds.

AutoQSAR Predict 

Choose structures to make predictions for and the model to apply.