| 书目名称 | Control and Prediction of Solid-State of Pharmaceuticals |
| 副标题 | Experimental and Com |
| 编辑 | Rajni Miglani Bhardwaj |
| 视频video | http://file.papertrans.cn/238/237342/237342.mp4 |
| 概述 | Nominated as an outstanding PhD thesis by the University of Strathclyde.Demonstrates the value of combined experimental and computational approaches for a better understanding of the key factors under |
| 丛书名称 | Springer Theses |
| 图书封面 |  |
| 描述 | .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... . |
| 出版日期 | Book 2016 |
| 关键词 | Physical Form Screening; Experimental Crystal Structure Landscape; Solid-State Diversity; Crystal Struc |
| 版次 | 1 |
| doi | https://doi.org/10.1007/978-3-319-27555-0 |
| isbn_softcover | 978-3-319-80169-8 |
| isbn_ebook | 978-3-319-27555-0Series ISSN 2190-5053 Series E-ISSN 2190-5061 |
| issn_series | 2190-5053 |
| copyright | Springer International Publishing Switzerland 2016 |
|Archiver|手机版|小黑屋|
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