2011 International Conference on Business Computing and Global Informatization 2011
DOI: 10.1109/bcgin.2011.95
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A QSAR Study on Neurotrophic Activities of N-p-Tolyl/phenylsulfonyl L-Amino Acid Thiolester Derivatives

Abstract: The objective of the present work was to study the quantitative structure-activity relationship (QSAR) of the protective effects of N-p-tolyl/phenylsulfonyl L-amino acid thiolester derivatives on anoxic damage of rat pheochromocytoma (PC12) cells. Four molecular parameters of seventeen N-p-tolyl/phenylsulfonyl L-amino acid thiolester derivatives, including heat of formation, dipole moment, the energy of the highest occupied molecular orbital and the energy of the lowest unoccupied molecular orbital, were calcu… Show more

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