Control and Prediction of Solid-State of Pharmaceuticals

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Focusing on experimental and computational methods, the thesis explores solid form discovery and the factors affecting solid-structure diversity. It emphasizes experimental work on two similar compounds and investigates how minor structural changes impact crystallization using various computational tools. Additionally, the author introduces a validated method employing Raman microscopy for efficient solid-state form screening. This research offers a cost-effective approach to predict the crystallizability of organic compounds based solely on molecular structure, highlighting key molecular influences on crystallization.