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Springer电子图书(1)	CNKI会议论文(22)	CNKI期刊论文0611(10)
万方学术会议(1)	CNKI学位论文(2225)	知网期刊论文(2406)

在“Elsevier电子期刊”中，命中：1,607条，耗时：0.0329911 秒

在所有数据库中总计命中：4,665条

1.In silico receptor-based drug design of X,Y-benzenesulfonamide derivatives as selective COX-2 inhibitors

作者：David J. Pé ; rez^a ; Orlando Sarabia^a ; Manuel Villanueva-Garcí ; a^b ; Kayim Pineda-Urbina^a ; Á ; ngel Ramos-Organillo^a ; Jorge Gonzalez-Gonzalez^a ; Zeferino Gó ; mez-Sandoval^a ; ^{zgomez@ucol.com} ; Rodrigo Said Razo-Herná ; ndez^a ; ^c ; ^{rrazo@ucol.mx}

关键词：QSAR ; Docking ; Cyclooxygenase ; Benzenesulfonamides ; Drug design ; Artificial neural networks

刊名：Comptes Rendus Chimie

出版年：2017

2.Polyfluorinated salicylic acid derivatives as analogs of known drugs: Synthesis, molecular docking and biological evaluation

作者：E.V. Shchegol'kov^a ; ^{schegolkov@ios.uran.ru} ; I.V. Shchur^a ; Ya.V. Burgart^a ; V.I. Saloutin^a ; A.N. Trefilova^b ; G.A. Ljushina^b ; S.Yu. Solodnikov^b ; L.N. Markova^b ; V.V. Maslova^b ; O.P. Krasnykh^b ; S.S. Borisevich^c ; S.L. Khursan^c

关键词：Polyfluoronated salicylates ; Nucleophilic substitution ; ortho-Methoxylation ; Molecular docking ; Anti-inflammatory and analgesic activities ; COX-1 inhibition ; Toxicity ; Permeability

刊名：Bioorganic & Medicinal Chemistry

出版年：2017

3.Quantitative structure-activity relationship and molecular docking studies of a series of quinazolinonyl analogues as inhibitors of gamma amino butyric acid aminotransferase

作者：Usman Abdulfatai ; ^{faithyikare4me@gmail.com} ; Adamu Uzairu ; Sani Uba

关键词：QSAR method ; Gamma aminobutyric acid aminotransferase ; Molecular docking ; Density functional theory ; Anticonvulsant ; Genetic function algorithm

刊名：Journal of Advanced Research

出版年：2017

4.Synthesis, screening and docking analysis of hispolon analogs as potential antitubercular agents

作者：Neduri V. Balaji^a ; Bollikolla Hari Babu^a ; ^{dr.b.haribabu@gmail.com} ; Gottumukkala V. Subbaraju^b ; Kurre Purna Nagasree^c ; Muthyala Murali Krishna Kumar^c ; ^{drmmkau@gmail.com}

关键词：Hispolons ; Antitubercular ; Ketoacyl synthase docking analysis

刊名：Bioorganic & Medicinal Chemistry Letters

出版年：2017

5.Green fluorescent protein chromophore derivatives as a new class of aldose reductase inhibitors

作者：Ryota Saito^a ; ^b ; ^{saito@chem.sci.toho-u.ac.jp} ; Maiko Hoshi^a ; Akihiro Kato^a ; Chikako Ishikawa^c ; Toshiya Komatsu^d

关键词：Aldose reductase inhibitor ; Drug candidates for diabetic complications ; GFP chromophore model ; (Z)-4-Arylmethylene-1H-imidazol-5(4H)-ones ; Docking study

刊名：European Journal of Medicinal Chemistry

出版年：2017

6.Interaction of anticancer drug clofarabine with human serum albumin and human α-1 acid glycoprotein. Spectroscopic and molecular docking approach

作者：Mohammad Rehan Ajmal^a ; Saima Nusrat^a ; Parvez Alam^a ; Nida Zaidi^a ; Mohsin Vahid Khan^a ; Masihuz Zaman^a ; Yasser E. Shahein^b ; Mohamed H. Mahmoud^c ; ^d ; Gamal Badr^e ; Rizwan Hasan Khan^a ; ^{rizwanhkhan1@gmail.com} ; ^{rizwanhkhan1@yahoo.com}

关键词：Human serum α-1 acid glycoprotein ; Human serum albumin ; Fluorescence quenching ; Circular dichroism ; Molecular docking ; Anticancer ; Clofarabine

刊名：Journal of Pharmaceutical and Biomedical Analysis

出版年：2017

7.The effects of fluorine substitution on the chemical properties and inhibitory capacity of Donepezil anti-Alzheimer drug; density functional theory and molecular docking calculations

作者：Azita Khosravan^a ; ^{a.khosravan@kgut.ac.ir} ; Safora Marani^b ; Mohammad Sadegh Sadeghi Googheri^b ; ^c ; ^{sadeghi.mohammadsadegh@gmail.com}

关键词：Alzheimer disease ; Donepezil ; Fluorination ; Molecular docking ; Density functional theory ; AIM ; NBO

刊名：Journal of Molecular Graphics and Modelling

出版年：2017

8.Augmented reversible photoswitching of drug-target interaction through “surface borrowing”

作者：Frank Erdmann^a ; ¹ ; ^{frank.erdmann@pharmazie.uni-halle.de} ; Weilin Lin^b ; ¹ ; Charlott Platzer^c ; Matthias Schmidt^c ; Wolfgang Sippl^c ; Gunter Fischer^d ; Yixin Zhang^b ; ^{yixin.zhang@bcube-dresden.de}

关键词：Ciclosporin ; Calcineurin ; Immunosuppression ; Light-switchable drug ; CsA

刊名：Biochemical Pharmacology

出版年：2017

9.Substituted (E)-2-(2-benzylidenehydrazinyl)-4-methylthiazole-5-carboxylates as dual inhibitors of 15-lipoxygenase & carbonic anhydrase II: synthesis, biochemical evaluation and docking studies

作者：Aamer Saeed^a ; ^{aamersaeed@yahoo.com} ; Shafi Ullah Khan^b ; Parvez Ali Mahesar^a ; Pervaiz Ali Channar^a ; Ghulam Shabir^a ; Jamshed Iqbal^b ; ^{drjamshed@ciit.net.pk}

关键词：Thiazoles ; 15-Lipoxygenase ; Bovine carbonic anhydrase II ; Docking studies

刊名：Biochemical and Biophysical Research Communications

出版年：2017

10.Synthesis, COX-1/2 inhibition activities and molecular docking study of isothiazolopyridine derivatives

作者：Piotr Świątek^a ; ^{piotr.swiatek@umed.wroc.pl} ; Malgorzata Strzelecka^a ; Rafal Urniaz^b ; Katarzyna Gębczak^c ; Tomasz Gębarowski^c ; Kazimierz Gąsiorowski^c ; Wieslaw Malinka^a

关键词：Isothiazolopyridine ; Cyclooxygenase inhibition ; Molecular docking

刊名：Bioorganic & Medicinal Chemistry

出版年：2017

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