Table of Contents

This is a complete list of all the methods that are available through ChemML Wrapper interface. You can click on each function for further information.

Table’s columns describe:
  • task and subtask: for an easier classification of methods

  • host: the main library/dependency required for running a method

  • function: the method name that determines a block/node of computation graph

  • input and output tokens: available tokens in each block that collect specific information and send/receive it to/from other blocks