mdb_keep_with_prop {cinf}R Documentation

Keep in molecular database only compounds containing values of a certain property

Description

Returns molecular databased composed of compounds possessing values of a given property

Usage

mdb_keep_with_prop(mdb, prop_to_keep)

Arguments

mdb

Molecular database

prop_to_keep

Property that should be specified in all compounds of the returned molecular database

Value

Molecular database

Examples

data("alkans74")
mdb_keep_with_prop(alkans74.mdb, "mp")

[Package cinf version 0.0-19 Index]