QSAR Study of the Biologically Active Organosulfurs in Natural Products
The biological activities of two sets of a total of 30 different polysulfides were investigated using QSAR. The semiempirical AM1 in Gaussian 2003 for windows was used to optimize the structures whereas a subsequent calculation of hundreds of various types of descriptors at the density functional (B...
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Main Author: | |
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Format: | Article |
Language: | English |
Published: |
Wiley
2010-01-01
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Series: | E-Journal of Chemistry |
Online Access: | http://dx.doi.org/10.1155/2010/763452 |
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