get.atomic.desc.names

Get class names for atomic descriptors

Allows the user to access functionality in the
'CDK', a Java framework for chemoinformatics. This allows the user to load
molecules, evaluate fingerprints, calculate molecular descriptors and so on.
In addition, the 'CDK' API allows the user to view structures in 2D.

Zachary CharlopPowers

rcdk

Interface to the 'CDK' Libraries

Rajarshi Guha

Zachary Charlop-Powers

Emma Schymanski

get.atomic.desc.names function

<dl><dt>type</dt>
<dd>A string indicating which class of descriptors to return. Specifying
`"all"` will return class names for all molecular descriptors. Options include
* topological
* geometrical
* hybrid
* constitutional
* protein
* electronic</dd></dl>

Arguments

Rajarshi Guha (<a href="/link/rajarshi.guha%40gmail.com?package=rcdk&version=3.8.1" data-mini-rdoc="rcdk::rajarshi.guha@gmail.com">rajarshi.guha@gmail.com</a>)

Author

Get class names for atomic descriptors — get.atomic.desc.names

<dl>

<dt>type</dt>
<dd>A string indicating which class of descriptors to return. Specifying
`"all"` will return class names for all molecular descriptors. Options include
* topological
* geometrical
* hybrid
* constitutional
* protein
* electronic</dd>

</dl>

Rajarshi Guha (<a href='mailto:rajarshi.guha@gmail.com'>rajarshi.guha@gmail.com</a>)

get.atomic.desc.names: Get class names for atomic descriptors

Description

Usage

Value

Arguments

Author