minimalNPCTable

<p>A table with the NPClassifier pathways, superclasses and classes,
along with the compound names, smiles and inchikey. Generated by
the <code>NPCTable</code> function used on the
<code>minimalCompData</code> dataset.</p>

datasets

Quantify and visualise various measures of chemical diversity and
dissimilarity, for phytochemical compounds and other sets of chemical
composition data. Importantly, these measures can incorporate biosynthetic
and/or structural properties of the chemical compounds, resulting in a more
comprehensive quantification of diversity and dissimilarity. For details,
see Petrén, Köllner and Junker (2023) <doi:10.1111/nph.18685>.

Hampus Petr<c3><a9>n

chemodiv

Analysing Chemodiversity of Phytochemical Data

Hampus Petrén

Tobias G. Köllner

Robert R. Junker

minimalNPCTable function

<p>A dataframe with 3 compounds and their NPClassifier classifications.</p>

Format

Minimal NPClassifier table — minimalNPCTable

Minimal NPClassifier table

minimalNPCTable: Minimal NPClassifier table

Description

Usage

Arguments

Format