Sensitivity Limits for Determining 1:1 Binding Constants from Spectrophotometric Titrations via Global Analysis
Journal of Chemometrics, 2019
Recommended citation: Kazmierczak, N.P., Chew, J.A., Michmerhuizen, A.R., Kim, S.E., Drees, Z.D., Rylaarsdam, A., Thong, T., Van Laar, L., Vander Griend, D.A. Journal of Chemometrics, 2019, 33:e3119. Online access
We use Monte Carlo simulations on UV-vis titration data to quantify the robustness of global analysis for determining 1:1 binding constants in the presence of various types of errors and in different binding regimes. We also propose an experimental design framework to study such binding constants with high precision.