引用本文:
Jian Li, Xiu Lian Ju, Feng Chao Jiang. Pharmacophore model for neonicotinoid insecticides[J]. Chinese Chemical Letters,
2008, 19(5): 619-622.
doi:
10.1016/j.cclet.2008.03.011
Citation: Jian Li, Xiu Lian Ju, Feng Chao Jiang. Pharmacophore model for neonicotinoid insecticides[J]. Chinese Chemical Letters, 2008, 19(5): 619-622. doi: 10.1016/j.cclet.2008.03.011
Citation: Jian Li, Xiu Lian Ju, Feng Chao Jiang. Pharmacophore model for neonicotinoid insecticides[J]. Chinese Chemical Letters, 2008, 19(5): 619-622. doi: 10.1016/j.cclet.2008.03.011
Pharmacophore model for neonicotinoid insecticides
摘要:
An effective prediction pharmacophore model (RMS=0.634, Correl=0.893, Weight=1.463, Config=11.940) was success-fully obtained by 3D-QSAR based on a series of nAChR (nicotinic acetylcholine receptors) agonists, which consists of a hydrogen-bonding acceptor, a hydrogen-bond donor, a hydrophobic aliphatic and a hydrophobic aromatic centre. This pharmacophore modelmay provide theoretical basis for designation and development of higher active insectici
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关键词:
- 3D-QSAR
- / Pharmacophore
- / nAChR
- / Neonicotinoid insecticides
English
Pharmacophore model for neonicotinoid insecticides
Abstract:
An effective prediction pharmacophore model (RMS=0.634, Correl=0.893, Weight=1.463, Config=11.940) was success-fully obtained by 3D-QSAR based on a series of nAChR (nicotinic acetylcholine receptors) agonists, which consists of a hydrogen-bonding acceptor, a hydrogen-bond donor, a hydrophobic aliphatic and a hydrophobic aromatic centre. This pharmacophore modelmay provide theoretical basis for designation and development of higher active insectici
-
Key words:
- 3D-QSAR
- / Pharmacophore
- / nAChR
- / Neonicotinoid insecticides
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