Simulations

PharmaCalc: Pharmacokinetic simulations

PharmaCalc requirs Java (external page http://www.java.com/en/).

Distribution of ionization species and logD-pH profiles

Distribution of ionization species Excel file

• to calculate the mole fractions of ionization species of compounds with up to ten pKa values
• to simulate partitioning of ionization species in octanol/buffer

IC50 determination with Excel Solver

Template for IC50 calculations Excel file

PET kinetic modeling: Matlab codes

Simulate input function and time activity curves for a 2-tissue compartment model
Download Neuroreceptor binding simulations (M, 16 KB) Matlab script

Acknowledge: Stefanie D. Krämer, Radiopharmaceutical Sciences / Biopharmacy, ETH Zurich, Switzerland. Cite: external page M.F. Alf et al., EJNMMI Research 2013, 3:61