By Defang Ouyang, Sean C. Smith
Molecular modeling strategies were normal in drug discovery fields for rational drug layout and compound screening. Now those thoughts are used to version or mimic the habit of molecules, and support us learn formula on the molecular point. Computational pharmaceutics allows us to appreciate the mechanism of drug supply, and to increase new drug supply systems.
The publication discusses the modeling of other drug supply structures, together with cyclodextrins, reliable dispersions, polymorphism prediction, dendrimer-based supply structures, surfactant-based micelle, polymeric drug supply platforms, liposome, protein/peptide formulations, non-viral gene supply platforms, drug-protein binding, silica nanoparticles, carbon nanotube-based drug supply platforms, diamond nanoparticles and layered double hydroxides (LDHs) drug supply systems.
Although there are various current books approximately rational drug layout with molecular modeling recommendations, those strategies nonetheless glance mysterious and daunting for pharmaceutical scientists. This publication fills the distance among pharmaceutics and molecular modeling, and provides a scientific and total advent to computational pharmaceutics. It covers all introductory, complicated and professional degrees. It presents a wholly diversified standpoint to pharmaceutical scientists, and should significantly facilitate the advance of pharmaceutics. It additionally is helping computational chemists to seem for the real questions within the drug supply field.
This ebook is integrated within the Advances in Pharmaceutical Technology e-book series.
Read or Download Computational pharmaceutics : application of molecular modeling in drug delivery PDF
Best nonfiction_13 books
This ebook bargains a accomplished assessment of modern stories performed at the organic results of steel nanoparticles. It additionally presents an outstanding theoretical beginning and numerous steel nanoparticle synthesis tools. half I reports the most chemical equipment used for synthesizing steel nanoparticles in an answer and describes unique approach to biochemical synthesis, in addition to a few certain techniques constructed in particular for learning the organic task of nanoparticles.
This quantity discusses the significance of adopting entrepreneurial and innovation practices within the public quarter, as mechanisms for detecting, facing and together with voters’ social wishes, with a mirrored image on optimistic selection in their caliber of lifestyles. It makes a speciality of serious mirrored image and rethinking the articulation among the scale of transformation – entrepreneurship and innovation – of latest Public administration (NPM).
- Advances in Knowledge Discovery and Management: Volume 5
- Capital and Labour on the Rhodesian Railway System, 1888–1947 (St Antony's Series)
- Morphology, Kinematics and Star Formation Across the Hubble Sequence of Galaxies
- Secure IT Systems: 20th Nordic Conference, NordSec 2015, Stockholm, Sweden, October 19-21, 2015, Proceedings (Lecture Notes in Computer Science)
- Elect in the Son: A Study of the Doctrine of Election
- Spin and Charge Ordering in the Quantum Hall Regime (Springer Theses)
Extra info for Computational pharmaceutics : application of molecular modeling in drug delivery
And Kendrick, J. (2008) A major advance in crystal structure prediction. Angewandte Chemie International Edition, 47 (13), 2427–2430. , et al. (2011) Successful prediction of a model pharmaceutical in the fifth blind test of crystal structure prediction. International Journal of Pharmaceutics, 418 (2), 168–178. , et al. (2013) Complex polymorphic system of gallic acid‐five monohydrates, three anhydrates, and over 20 solvates. Crystal Growth and Design, 13 (1), 19–23. , et al. 1]nonane‐2,4‐dione.
Journal of Physical Chemistry B, 112 (32), 9810–9829. A. A. (2005) Energy ranking of molecular crystals using density functional theory calculations and an empirical Van Der Waals correction. Journal of Physical Chemistry B, 109 (32), 15531–15541. G. L. (2010) Spontaneous resolution of enantiomers by crystallization: insights from computed crystal energy landscapes. Crystal Growth and Design, 10 (4), 1749–1756. , et al. (2007) Toward the computational design of diastereomeric resolving agents: an experimental and computational study of 1‐phenylethylammonium‐2‐phenylacetate derivatives.
2002) Crystal structure prediction of small organic molecules: a second blind test. Acta Crystallographica Section B: Structural Science, 58, 647–661. , et al. (2005) A third blind test of crystal structure prediction. Acta Crystallographica Section B: Structural Science, 61 (5), 511–527. , et al. (2009) Significant progress in predicting the crystal structures of small organic molecules – a report on the fourth blind test. Acta Crystallographica Section B: Structural Science, 65 (2), 107–125.