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@inbook{Lafitte:2019:10.1002/9781119600800.ch19,
author = {Lafitte, T and Papaioannou, V and Dufal, S and Pantelides, CC},
booktitle = {Chemical Engineering in the Pharmaceutical Industry},
doi = {10.1002/9781119600800.ch19},
pages = {439--466},
title = {A General framework for solid-liquid equilibria in pharmaceutical systems},
url = {http://dx.doi.org/10.1002/9781119600800.ch19},
year = {2019}
}

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TY  - CHAP
AB  - This chapter presents a unified framework for the determination of solid-liquid equilibria in complex pharmaceutical systems. The framework is based on a fundamental thermodynamics formulation of the combined phase and reaction equilibrium problem, supported by the emergence, over the past decade, of new equations of state (EoS) that are capable of accurately predicting liquid-phase behavior of mixtures involving complex intermolecular interactions. An important consideration in the context of any modeling framework is the amount of experimental data required for the characterization of any particular system of interest in terms of the parameters required by the model. This issue is considered in detail, with particular focus on the characterization of solid-phase behavior with minimal experimental solubility data. The chapter presents several examples illustrating key aspects of the proposed framework, and draws some general perspectives from these examples.
AU  - Lafitte,T
AU  - Papaioannou,V
AU  - Dufal,S
AU  - Pantelides,CC
DO  - 10.1002/9781119600800.ch19
EP  - 466
PY  - 2019///
SN  - 9781119285496
SP  - 439
TI  - A General framework for solid-liquid equilibria in pharmaceutical systems
T1  - Chemical Engineering in the Pharmaceutical Industry
UR  - http://dx.doi.org/10.1002/9781119600800.ch19
ER  -

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