Carte Control and Prediction of Solid-State of Pharmaceuticals RAJNI MIGL BHARDWAJ

Control and Prediction of Solid-State of Pharmaceuticals

Experimental and Computational Approaches

Limbă: engleză
Legare: Carte broșată
Disponibilitate: În depozitul extern
Expediem în 5-8 zile
551.35 lei
This thesis investigates a range of experimental and computational approaches for the discovery of s...

Informații despre carte

Limbă
engleză
Legare
Carte - Carte broșată
Publicat
2018
Pagini
238
EAN
9783319801698
ISBN
9783319801698
Enbook ID
19308708
Greutate
454
Dimensiuni
155 x 235 x 13

Descriere completă

This thesis investigates a range of experimental and computational approaches for the discovery of solid forms. Furthermore, we gain, as readers, a better understanding of the key factors underpinning solid-structure and diversity. A major part of this thesis highlights experimental work carried out on two structurally very similar compounds. Another important section involves looking at the influence of small changes in structure and substituents on solid-structure and diversity using computational tools including crystal structure prediction, PIXEL calculations, Xpac, Mercury and statistical modeling tools. In addition, the author presents a fast validated method for solid-state form screening using Raman microscopy on multi-well plates to explore the experimental crystallization space. This thesis illustrates an inexpensive, practical and accurate way to predict the crystallizability of organic compounds based on molecular structure alone, and additionally highlights the molecular factors that inhibit or promote crystallization.

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