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Citation: Chen Hong-Ming, Zhou Jia-Ju, Xie Gui-Rong, Ren Tian-Rui. A QSAR Research Method Based on Pseudoreceptor Model[J]. Acta Physico-Chimica Sinica, ;1997, 13(07): 626-631. doi: 10.3866/PKU.WHXB19970710 shu

A QSAR Research Method Based on Pseudoreceptor Model

1.
Laboratory of Computer Chemistry,Chinese Academy of Science,Beijing 100080

Received Date: 23 December 1996
Available Online: 15 July 1997

In this paper, PARM al rithm which can be used in QSAR research was put forward. In this al rithm, a set of pseudo atom was defined and a series of pseudo receptor model was generated by using genetic al rithm. These models which have high correlation between receptor-liagnd interaction and bioactivity can predict bioactivity of unknown molecules. This al rithm was used to investigate the K+ channel opener system. The reasonable results were obtained.
- Pseudoreceptor model,
- Genetic al rithm,
- Quantitative structure-activity-relationship
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