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A Partition Coefficient Calculation Method with the SFED Model

โœ Scribed by In, Youngyong; Chai, Han Ha; No, Kyoung Tai


Book ID
118239523
Publisher
American Chemical Society
Year
2005
Tongue
English
Weight
329 KB
Volume
45
Category
Article
ISSN
0095-2338

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๐Ÿ“œ SIMILAR VOLUMES


Calculation of partition coefficients by
โœ Gilles Klopman; Linda D. Iroff ๐Ÿ“‚ Article ๐Ÿ“… 1981 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 357 KB

## Abstract A new method is presented for the calculation of partition coefficients of solutes in water lipid systems. Log __P__ values are calculated based on the charge densities of the atoms as determined by quantum mechanical methods. In this article, the results have been obtained from charge