CCL: Release note of XLOGP3

["ccl" <ccl||mail.sioc.ac.cn>]

Dear CCLers,

 

We announce the release of the latest version of the XLOGP program, namely XLOGP3. XLOGP3 computes octanol/water partition coefficients (logP) of organic compounds by combining the powers of an additive model and a similarity-based strategy (J. Chem. Inf. Model. 2007, 47, 2140-2148). It demonstrates much improved accuracy over its previous versions, and is at least comparable to other successful logP methods in our tests.

 

XLOGP3 is available for free to download for academic and governmental users. We provide pre-compiled executable codes for UNIX/LINUX and Windows platforms. On-line computing by XLOGP3 is provided to all users at http://www.sioc-ccbg.ac.cn/software/xlogp3/. A discussion forum for XLOGP3 is provided at http://www.sioc-ccbg.ac.cn/forum/. We welcome any feedback from you!

Best regards,

 

Renxiao Wang, Ph.D.
Professor
Shanghai Institute of Organic Chemistry
China, P.R.