Home » Nonfiction » Andreas Klamt » COSMO-RS

April 19 , 2008


From Quantum Chemistry to Fluid PhaseThermodynamics and Drug Design


The COSMO-RS technique is a novel method for predicting the thermodynamic properties of pure and mixed fluids which are important in many areas, ranging from chemical engineering to drug design.

COSMO-RS, From Quantum Chemistry to Fluid Phase Thermodynamics and Drug Design is about this novel technology, which has recently proven to be the most reliable and efficient tool for the prediction of vapour-liquid equilibria. In contrast to group contribution methods, which depend on an extremely large number of experimental data, COSMO-RS calculates the thermodynamic data from molecular surface polarity distributions, resulting from quantum chemical calculations of the individual compounds in the mixture. In this book, the author cleverly combines a vivid overview of the partly demanding theoretical steps with a deeper analysis of their scientific background and justification.

Aimed at theoretical chemists, computational chemists, physical chemists, chemical engineers, thermodynamicists as well as students,academic and industrial experts, COSMO-RS, From Quantum Chemistry to Fluid Phase Thermodynamics and Drug Design provides a novel viewpoint to anyone looking to gain more insight into the theory and potential of the unique method, COSMO-RS.

All disc-based content for this title is now available on the Web.

Download epub2

Read also


The story of Fidel Castro has few parallels in contemporary history. None of the outstanding Third World leaders of the twentieth-century played such a prominent and restless part on the international stage and none survived as head of state for as long. Over almost 50 years, he was one of the most controversial political figures in the world, and…

* The only book currently available on COSMO-RS technique
* Provides a novel viewpoint for the scientific understanding and for the practical quantitative treatment of fluid phase thermodynamics
* Includes illustrative examples of the COSMOtherm program
Show more...

How to download book

Buy this book

You can buy this book now only for $202.49. This is the lowest price for this book.

Buy book

Download book free

If you want to download this book for free, please register, approve your account and get one book for free.


After that you may download book «COSMO-RS»:

Download Amazon Kindle:


Download XML Book:


Download Papyre FB2:


Download TXT: