黄小琴

作品数：6被引量：1H指数：0
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供职机构：中国科学院上海药物研究所更多>>
发文主题：LIKECOMPARATIVERECEPTOR乙酰胆碱酯酶抑制剂乙酰胆碱更多>>
发文领域：医药卫生更多>>
发文期刊：《Acta Pharmacologica Sinica》更多>>
所获基金：国家自然科学基金更多>>
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A 3D-structural modei of memapsin 2 protease generated from theoretical study
《Acta Pharmacologica Sinica》2001年第1期52-58,共7页黄小琴 蒋华良 罗小民 沈竞康 陈凯先 嵇汝运 曹阳 薛红 
National Natural Science Foundation of China (№ 29725203);State Key Program of Basic Ressearch of China (№ 1998051115)
AIM: To build a 3D-structural model of memapsin 2 (M2) protease for theoretical study and drug design. METHODS: Structural alignment was performed based on multiple and pairwise sequence alignment of three templates. ...
关键词：Alzheimer disease amyloid β-protein templates drug design 
Building 3D-structural model of kappa opioid receptor and studying its interaction mechanism with dynorphin A(1-8)~1
《Acta Pharmacologica Sinica》2000年第8期32-39,共8页万旭虎 黄小琴 周德和 蒋华良 陈凯先 池志强 
To construct the 3D-structural model of human kappa opioid receptor (HKOR) and study its interacting mechanism with dynorphin A( 1 - 8) (Dyn8). METHODS: Comparative molecular modeling was applied to build the 7 transm...
关键词：molecular dynamics simulation kappa opioid receptors molecular models binding sites DYNORPHINS 
Building three-dimensional structures of HIV-1 coreceptor CCR5 and its interaction with antagonist TAK779 by comparative molecular modeling
《Acta Pharmacologica Sinica》2000年第6期43-50,共8页黄小琴 蒋华良 罗小民 陈凯先 嵇汝运 曹阳 裴钢 
Project supported by the Key Program of National Natural Science Foundation of China (Grants 29790123 and 29725203)
AIM: To study the mechanism of interaction of CCR5 receptor with its antagonist TAK779. METHODS: Comparative molecular modeling has been used to develop the 3D-structural models of CCR5 receptor and its complex with T...
关键词：TAK 779 CCR5 receptor molecular structure HIV-1 computer aided design 
Comparative molecular modeling on 3D-structure of opioid receptor-like 1 receptor被引量：1
《Acta Pharmacologica Sinica》2000年第6期51-57,共7页黄小琴 蒋华良 罗小民 陈凯先 朱友成 嵇汝运 曹阳 
Project supported by the Key Programs of National Natural Science Foundation of China (Grants 29790123 and 29725203)
AIM: To build the three-dimensional structure of opioid receptor-like 1 (ORL1) receptor. METHODS: Structural elements of ORL1 receptor were predicted from sequence alignments of opioid and related receptors of G prote...
关键词：frog rhodopsin ORL1 receptors templates molecular models molecular mechanics 
Study on mechanism of interaction of nociceptin and opioids binding with opioid receptor-like 1 receptor
《Acta Pharmacologica Sinica》2000年第6期58-68,共11页黄小琴 蒋华良 罗小民 陈凯先 朱友成 嵇汝运 曹阳 
Project supported by the Key Programs of National Natural Science Foundation of China (Grants 29790123 and 29725203)
AIM: To study the mechanism of interaction of noci-ceptin and opioids with ORL1 receptor. METHODS: Molecular dynamics study was carried out before noci-ceptin was manually docked into the binding site of ORL1 receptor...
关键词：NOCICEPTIN lofentanyl etorphine ORLl receptor molecular docking binding energy 
Molecular modeling on solvent effect and interaction mechanism of fentanyl analogs to μ-opioid receptor^1
《Acta Pharmacologica Sinica》2000年第1期48-56,共9页黄小琴 蒋华良 罗小民 戎锁宝 顾建德 谭小健 朱友成 陈凯先 嵇汝运 曹阳 
Project supported by the Key Programs of National Natural Science Foundation of China (No 29790123 and 29725203).
AIM: To do theoretical study about solvation effect and interaction mechanism of fentanyl analogs (FA) to μ opioid receptor (μOR). METHODS: Flexible docking (FlexiDock) was performed by using the possible active con...
关键词：FENTANYL molecular models solvents binding pocket structure-activity relationship 
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