Predicting minimum energy structure of a peptide via a modified potential smoothing kernel

A global optimization approach is proposed for finding the global minimum energy configuration of a peptide. First, the original nonsmooth total potential energy function of a peptide, composed using the AMBER model, is transformed to a smoother function (shifted-impulsive transformation) via a pro...

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Main Authors: Leong, Wah June, Abu Hassan, Malik
格式: Article
語言:English
出版: Institute for Mathematical Research, Universiti Putra Malaysia 2008
在線閱讀:http://psasir.upm.edu.my/id/eprint/12595/1/03.LEONG_WAH_JUNE.pdf
http://psasir.upm.edu.my/id/eprint/12595/
http://einspem.upm.edu.my/journal/volume2.2.php
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