insysbio/drug-loaded-nanoparticles

PBPK Modeling For Therapeutic Nanoparticles Loaded With Drug

Drug Loaded Nanoparticles

PBPK Modeling For Therapeutic Nanoparticles Loaded With Drug

This repository includes the model reproduced from the the paper and datasets from figures and the supplementary materials:

Shalgunov et al. Comprehensive study of the drug delivery properties of poly(l-lactide)-poly(ethylene glycol) nanoparticles in rats and tumor-bearing mice. 2017 Journal of Controlled Release 261. DOI: 10.1016/j.jconrel.2017.06.006

Known restrictions

• "Units inconsistency" messages for some records: v, vrel because of limited support of fractional units in Heta. But this doesn't affect simulation results.

Diagnostics

The original model and parameters

Simulated vs measured dependence of average VCR concentration for the NP of type U16c.

You find other diagnostic plots in the directory /diagnostics/reproduced model/

Reproduced in HetaSimulator.jl and fitted

Exported formats

See dist branch

TODO

• Simulations and experimental data in HetaSimulator
• Share the datasets
• Reproduce fitting

Contributors

Evgeny Metelkin is the author of the Heta-based modeling code.

The model and data in the study were reproduced from the published study. The authors of the original study are: V. Shalgunov, D. Zaytseva-Zotova, A. Zintchenko, T. Levada, Y. Shilov, D. Andreyev, D. Dzhumashev, E. Metelkin, A. Urusova, O. Demin, K. McDonnell, G. Troiano, S. Zale, E. Safarovа