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在“Elsevier电子期刊”中，命中：87条，耗时：0.0759682 秒

在所有数据库中总计命中：168条

1.Interactions of human P-glycoprotein transport substrates and inhibitors at the drug binding domain: Functional and molecular docking analyses

作者：Onat Kadioglu^a ; Mohamed E.M. Saeed^a ; Massimo Valoti^b ; Maria Frosini^b ; Giampietro Sgaragli^b ; ^{sgaragli@unisi.it" class="auth_mail" title="E-mail the corresponding author} ; Thomas Efferth^a ; ^{efferth@uni-mainz.de" class="auth_mail" title="E-mail the corresponding author}

关键词：CSA ; cyclosporin A ; DBD ; drug-binding domain ; DMD ; defined molecular docking ; EPI ; epirubicin ; LBE ; lowest binding energy ; MDA ; molecular docking analysis ; MDR ; multidrug resistance ; MFI ; mean fluorescence intensity ; P-gp ; P-glycoprotein ; R123 ; rhodamine 123 ; VMD ; Visual Molecular Dynamics

刊名：Biochemical Pharmacology

出版年：2016

2.Structure binding relationship of human surfactant protein D and various lipopolysaccharide inner core structures

作者：Anika Reinhardt^a ; ^b ; Marko Wehle^d ; Andreas Geissner^a ; ^b ; Erika C. Crouch^c ; Yu Kang^d ; ¹ ; You Yang^a ; ³ ; Chakkumkal Anish^a ; ² ; Mark Santer^d ; ^{mark.santer@mpikg.mpg.de" class="auth_mail" title="E-mail the corresponding author} ; Peter H. Seeberger^a ; ^b ; ^{peter.seeberger@mpikg.mpg.de" class="auth_mail" title="E-mail the corresponding author}

关键词：Surfactant protein D ; D324N ; + ; D325N ; + ; R343K mutant ; Carbohydrate recognition domain ; Lipopolysaccharide inner core structure ; Gram-negative bacteria ; Glycan array ; Surface plasmon resonance ; Molecular docking ; Molecular dynamics simulations ; Synthetic glycans ; Glycan binding affinity

刊名：Journal of Structural Biology

出版年：2016

3.Resveratrol inhibits Trypanosoma cruzi arginine kinase and exerts a trypanocidal activity

作者：Edward A. Valera Vera^a ; Melisa Sayé ; ^a ; Chantal Reigada^a ; Flá ; via S. Damasceno^b ; Ariel M. Silber^b ; Mariana R. Miranda^a ; Claudio A. Pereira^a ; ^{cpereira@retina.ar" class="auth_mail" title="E-mail the corresponding author}

关键词：Polyphenols ; Resveratrol ; Trypanosoma cruzi ; Arginine kinase ; Molecular docking ; Chagas disease

刊名：International Journal of Biological Macromolecules

出版年：2016

4.α-Cyperone of Cyperus rotundus is an effective candidate for reduction of inflammation by destabilization of microtubule fibers in brain

作者：Azam Azimi^a ; Seyed Mahmood Ghaffari^a ; Gholam Hossein Riazi^a ; ^{ghriazi@ut.ac.ir} ; Seyed Shahriar Arab^b ; Mohammad Mehdi Tavakol^c ; Shahriar Pooyan^a

关键词：α-Cyperone (PubChem CID ; 6452086) ; ATP (PubChem CID ; 5957) ; GTP (PubChem CID ; 6830)

刊名：Journal of Ethnopharmacology

出版年：2016

5.Quinoxalinone (Part II). Discovery of (Z)-3-(2-(pyridin-4-yl)vinyl)quinoxalinone derivates as potent VEGFR-2 kinase inhibitors

作者：Leilei Shi^a ; Jianfeng Zhou^b ; Jifeng Wu^c ; Junya Cao^d ; Yuemao Shen^a ; Hua Zhou^e ; Xun Li^a ; ^{tjulx2004@sdu.edu.cn" class="auth_mail" title="E-mail the corresponding author}

关键词：VEGFR-2 inhibitor ; Quinoxalinone derivates ; Antiangiogenesis ; Pyridyl motif ; Activity evaluation

刊名：Bioorganic & Medicinal Chemistry

出版年：2016

6.Deeper insights into the drug defense of glioma cells against hydrophobic molecules

关键词：Glioma cells ; Selective photo-activation ; Hypericin ; Antraquinones ; P-glycoprotein

刊名：International Journal of Pharmaceutics

出版年：2016

7.An evaluation of indirubin analogues as phosphorylase kinase inhibitors

作者：Jaida Begum^a ; ^b ; Vassiliki T. Skamnaki^c ; Colin Moffatt^b ; Nicolas Bischler^d ; Josephine Sarrou^d ; Alexios-Leandros Skaltsounis^e ; Demetres D. Leonidas^c ; Nikos G. Oikonomakos^d ; ¹ ; Joseph M. Hayes^a ; ^b ; ^{jhayes@uclan.ac.uk" class="auth_mail" title="E-mail the corresponding author}

关键词：AU-ROC ; area under receiver operator characteristic ; DFT ; density functional theory ; MD ; molecular dynamics ; NSLR ; normalized sum of the logarithm of ranks ; NSMLR ; normalized sum of the modified logarithm of ranks ; PhK ; phosphorylase kinase ; QM/MM ; quantum mechanics/molecular mechanics ; QM/MM-PBSA ; quantum mechanics/molecular mechanics&ndash ; Poisson Boltzmann surface area ; QM-PLD ; quantum mechanics-polarized ligand docking ; ROC ; receiver operator characteristic ; SAR ; structure activity relations

刊名：Journal of Molecular Graphics and Modelling

出版年：2015

8.Novel Interaction of Ornithine Decarboxylase with Sepiapterin Reductase Regulates Neuroblastoma Cell Proliferation

作者：Ingo Lange ; Dirk Geerts ; David J. Feith ; Gabor Mocz ; Jan Koster ; Andr茅 S. Bachmann

关键词：ODC ; ornithine decarboxylase ; SPR ; sepiapterin reductase ; NOS ; nitric oxide synthase ; NB ; neuroblastoma ; DAPI ; 4&prime ; 6-diamidino-2-phenylindole ; BP ; blocking peptide ; HEK293 ; human embryonic kidney 293 ; FBS ; fetal bovine serum ; PBS ; phosphate-buffered saline

刊名：Journal of Molecular Biology

出版年：23 January, 2014

9.Modeling the zing finger protein SmZF1 from Schistosoma mansoni: Insights into DNA binding and gene regulation

作者：Mainá ; Bitar^a ; ^b ; ¹ ; Marcela Gonç ; alves Drummond^b ; ^c ; ¹ ; Mauricio Garcia Souza Costa^a ; ¹ ; Francisco Pereira Lobo^d ; Carlos Eduardo Calzavara-Silva^e ; Paulo Mascarello Bisch^a ; Carlos Renato Machado^b ; André ; a Mara Macedo^b ; Raymond J. Pierce^c ; Gló ; ria Regina Franco^b ; ^{gfrancoufmg@gmail.com}

关键词：Schistosoma mansoni ; SmZF1 ; Zinc finger ; Transcriptional regulation ; Comparative modeling ; Molecular dynamics

刊名：Journal of Molecular Graphics and Modelling

出版年：2013

10.Structural basis for the design and synthesis of selective HDAC inhibitors

作者：Simone Di Micco ; Maria Giovanna Chini ; Stefania Terracciano ; Ines Bruno ; Raffaele Riccio ; Giuseppe Bifulco ; ^{bifulco@unisa.it}

关键词：Antitumor agents ; HDAC selective inhibitors ; Histone Deacetylase ; Molecular modeling ; DFT

刊名：Bioorganic and Medicinal Chemistry

出版年：2013

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