pksim.pcs

<p>Dallmann et al. (2018) made use of PK-Sim to predict chemical- and tissue-
specific partition coefficients. The methods include both the default
PK-Sim approach and PK-Sim Standard and Rodgers &amp; Rowland (2006).</p>
<p>Dallmann et al. (2018) made use of PK-Sim to predict chemical- and tissue-
specific partition coefficients. The methods include both the default
PK-Sim approach and PK-Sim Standard and Rodgers &amp; Rowland (2006).</p>

data

High throughput toxicokinetics ("HTTK") is the
combination of 1) chemical-specific in vitro measurements or in
silico predictions and 2) generic mathematical models, to
predict absorption, distribution, metabolism, and excretion by the
body. HTTK methods have been described by Pearce et al. (2017)
(<doi:10.18637/jss.v079.i04>) and Breen et al. (2021) (<doi:10.1080/17425255.2021.1935867>).
Here we provide examples (vignettes) applying HTTK to solve various
problems in bioinformatics, toxicology, and exposure science.
In accordance with Davidson-Fritz et al. (2025) (<doi:10.1371/journal.pone.0321321>),
whenever a new HTTK model is developed, the code to generate the
figures evaluating that model is added as a new vignettte.

John Wambaugh

httkexamples

High-Throughput Toxicokinetics Examples

Robert Pearce

Caroline Ring

Greg Honda

Matt Linakis

Dustin Kapraun

Kimberly Truong

Meredith Scherer

Annabel Meade

Celia Schacht

Elaina Kenyon

pksim.pcs function

Format

Partition Coefficients from PK-Sim — pksim.pcs

Partition Coefficients from PK-Sim

pksim.pcs: Partition Coefficients from PK-Sim

Description

Usage

Arguments

Format

References