createQSARDatasets: Creates QSAR datasets

Description Usage Arguments Value

Description

Creates QSAR datasets.

Usage

1
2
createQSARDatasets(.connection, .targets, .molrepresentation, .response,
  .nrow_min = NULL, .nrow_max = NULL)

Arguments

.connection

a database connection created using dplyr::src_*.

.targets

a Targets object.

.molrepresentation

a MolRepresentation object.

.response

name of the response variable (character).

.nrow_min

min number of molecules per dataset (numeric). Default: NULL.

.nrow_max

max number of molecules per dataset (numeric). Default: NULL.

Value

A QSARDatasets object.


iaolier/rQSAR documentation built on May 7, 2019, 11:11 a.m.