Art
J-GLOBAL ID：201402211741265845   Reference number：14A0105675

Molecular Docking, QSAR and Molecular Dynamics Simulation on Spiro-oxindoles as MDM2 Inhibitors

MDM2阻害剤としてのスピロ-オキシインドールにおける分子ドッキング,QSAR,および分子動態シミュレーション
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Author (5)：
Li Bo

About Li Bo

(West China School of Pharmacy, Sichuan Univ., Chengdu)

About West China School of Pharmacy, Sichuan Univ., Chengdu

, 
Zhou Rui

About Zhou Rui

(West China School of Pharmacy, Sichuan Univ., Chengdu)

About West China School of Pharmacy, Sichuan Univ., Chengdu

, 
He Gu

About He Gu

(West China School of Pharmacy, Sichuan University; State Key Lab. of Biotherapy, Chengdu)

About West China School of Pharmacy, Sichuan University; State Key Lab. of Biotherapy, Chengdu

, 
Guo Li

About Guo Li

(West China School of Pharmacy, Sichuan Univ., Chengdu)

About West China School of Pharmacy, Sichuan Univ., Chengdu

, 
Huang Wei

About Huang Wei

(School of Pharmacy, Chengdu Univ. of Traditional Chinese Medicine, Chengdu)

About School of Pharmacy, Chengdu Univ. of Traditional Chinese Medicine, Chengdu


Material：
Huaxue Xuebao  (Acta Chimica Sinica)

About Huaxue Xuebao


Volume： 71  Issue： 10  Page： 1396-1403  Publication year： 2013 
JST Material Number： H0391B  ISSN： 0567-7351  CODEN： HHHPA4  Document type： Article
Article type： 原著論文  Country of issue： China (CHN)  Language： CHINESE (ZH)
Thesaurus term：
Thesaurus term/Semi thesaurus term
Keywords indexed to the article.
All keywords is available on JDreamIII(charged).
On J-GLOBAL, this item will be available after more than half a year after the record posted. In addtion, medical articles require to login to MyJ-GLOBAL.
docking

About docking

, 
molecular recognition

About molecular recognition

, 
Quantitative Structure-Activity Relationship

About Quantitative Structure-Activity Relationship

, 
Computer Simulation

About Computer Simulation

, 
*drug

About drug

, 
*peptide synthase

About peptide synthase

, 
*oncoprotein

About oncoprotein

, 
cytotoxicity

About cytotoxicity

, 
interaction

About interaction

, 
prostatic tumor

About prostatic tumor

, 
nitrogen heterocyclic compound

About nitrogen heterocyclic compound

, 
hydroxy compound

About hydroxy compound

, 
polynuclear aromatic compound

About polynuclear aromatic compound

, 
Molecular Dynamics Simulation

About Molecular Dynamics Simulation

, 
*mdm2 protein

About mdm2 protein

, 
computer application

About computer application

, 
utilization

About utilization


Semi thesaurus term：
Thesaurus term/Semi thesaurus term
Keywords indexed to the article.
All keywords is available on JDreamIII(charged).
On J-GLOBAL, this item will be available after more than half a year after the record posted. In addtion, medical articles require to login to MyJ-GLOBAL.
molecular docking

About molecular docking

, 
QSAR

About QSAR

, 
Molecular Dynamics Simulation

About Molecular Dynamics Simulation

, 
*inhibitor

About inhibitor

, 
*Mdm2

About Mdm2

, 
Prostatic Cancer

About Prostatic Cancer


JST classification (1)：
JST classification
Category name(code) classified by JST.
Physicochemical pharmacy in general 
(GV01010J)

About Physicochemical pharmacy in general

Substance index (1)：
Substance index
Chemical Substance indexed to the Article.
Oxindol

About Oxindol

Terms in the title (6)：
Terms in the title
Keywords automatically extracted from the title.
MDM2

About MDM2

, 
阻害剤

About 阻害剤

, 
オキシインドール

About オキシインドール

, 
分子ドッキング

About 分子ドッキング

, 
QSAR

About QSAR

, 
分子動態シミュレーション

About 分子動態シミュレーション


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