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Wiley电子期刊(81)	SpringerLink电子期刊(1268)	NATURE电子期刊(69)	ACS电子期刊(1751)
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在“Elsevier电子期刊”中，命中：3,851条，耗时：0.122971 秒

在所有数据库中总计命中：7,032条

1.Computing the binding affinity of a ligand buried deep inside a protein with the hybrid steered molecular dynamics

作者：Oscar D. Villarreal^a ; ¹ ; Lili Yu^a ; ^b ; ¹ ; Roberto A. Rodriguez^a ; Liao Y. Chen^a ; ^{Liao.Chen@utsa.edu}

关键词：Binding affinity ; Retinol-binding protein ; Ligand-protein interaction ; T4-lysozyme mutants ; Molecular dynamics

刊名：Biochemical and Biophysical Research Communications

出版年：2017

2.Hot spot mapping of protein surfaces with TEMPOL: Bovine pancreatic RNase A as a model system

作者：Neri Niccolai^a ; ^{neri.niccolai@unisi.it} ; Edoardo Morandi^a ; ^{edoardo.morandi@student.unisi.it} ; Simone Gardini^a ; ^{simone.gardini@student.unisi.it} ; Valentino Costabile^a ; ^{valentino.costabile@student.unisi.it} ; Roberta Spadaccini^b ; ^{rspadacc@unisannio.it} ; Orlando Crescenzi^c ; ^{orlando.crescenzi@unina.it} ; Delia Picone^c ; ^{delia.picone@unina.it} ; Ottavia Spiga^a ; ^{ottavia.spiga@unisi.it} ; Andrea Bernini^a ; ^{andrea.bernini@unisi.it}

关键词：PRE ; paramagnetic relaxation enhancements ; NHbb ; protein backbone amide group ; HB ; hydrogen bond ; MSCS ; multiple solvent crystal structure

刊名：Biochimica et Biophysica Acta (BBA) - Proteins and Proteomics

出版年：2017

3.Thermodynamic contribution of backbone conformational entropy in the binding between SH3 domain and proline-rich motif

作者：Danyun Zeng ; Qingliang Shen ; Jae-Hyun Cho ; ^{jaehyuncho@tamu.edu}

关键词：Intrinsically disordered proteins ; Conformational entropy ; SH3 domain ; Proline-rich motif ; Protein-protein interactions

刊名：Biochemical and Biophysical Research Communications

出版年：2017

4.Indole-3-carbinol (I3C) analogues are potent small molecule inhibitors of NEDD4-1 ubiquitin ligase activity that disrupt proliferation of human melanoma cells

作者：Jeanne G. Quirit^a ; ^{jgquirit@berkeley.edu} ; Sergey N. Lavrenov^b ; ^{satory@mail.ru} ; Kevin Poindexter^a ; ^{kpoindexter25@gmail.com} ; Janice Xu^a ; ^{jamicexu@scripps.edu} ; Christine Kyauk^a ; ^{ckyauk@berkeley.edu} ; Kathleen A. Durkin^c ; ^{durkin@berkeley.edu} ; Ida Aronchik^a ; ^{idaaronchik@gmail.com} ; Thomas Tomasiak^d ; ^{tomasiak@msg.ucsf.edu} ; Yaroslav A. Solomatin^b ; ^{hercules44@yandex.ru} ; Maria N. Preobrazhenskaya^b ; ^{satory@mail.ru} ; Gary L. Firestone^a ; ^{glfire@berkeley.edu}

关键词：Indole-3-carbinol analogues ; Ligand-target protein interactions ; NEDD4-1 ubiquitin ligase ; In silico computational modeling ; Anti-cancer compounds ; Melanoma cells

刊名：Biochemical Pharmacology

出版年：2017

5.Ligand and Target Discovery by Fragment-Based Screening in Human Cells

作者：Christopher G. Parker¹ ; ⁵ ; ^{cparker@scripps.edu} ; Andrea Galmozzi¹ ; ⁵ ; Yujia Wang¹ ; Bruno E. Correia² ; Kenji Sasaki¹ ; Christopher M. Joslyn¹ ; Arthur S. Kim¹ ; Cullen L. Cavallaro³ ; R. Michael Lawrence³ ; Stephen R. Johnson³ ; Iñ ; igo Narvaiza⁴ ; Enrique Saez¹ ; ^{esaez@scripps.edu} ; Benjamin F. Cravatt¹ ; ⁶ ; ^{cravatt@scripps.edu}

关键词：fragment-based ligand discovery ; FBLD ; chemical proteomics ; mass spectrometry ; photoreactivity ; phenotypic screening ; ligands ; chemical probes ; PGRMC2 ; adipogenesis

刊名：Cell

出版年：2017

6.Biophysical characterization of the interaction between M2-1 protein of hRSV and quercetin

作者：Thiago Salem Panç ; onato Teixeira^a ; ^c ; ^{thiago_spt@yahoo.com.br} ; Í ; caro Putinhon Caruso^b ; ^c ; ^{ykrocaruso@hotmail.com} ; Bruno Rafael Pereira Lopes^e ; ^{brunorpl@hotmail.com} ; Luis Octá ; vio Regasini^d ; ^{luisregasini@gmail.com} ; Karina Alves de Toledo^e ; ^{karinafcla@gmail.com} ; Marcelo André ; s Fossey^b ; ^c ; ^{mafossey@gmail.com} ; Fá ; tima Pereira de Souza^b ; ^c ; ^{fatyssouza@gmail.com} ; ^{fatyssouza@yahoo.com.br}

关键词：hRSV ; M2-1 ; Quercetin ; Biophysical analyses ; Molecular docking

刊名：International Journal of Biological Macromolecules

出版年：2017

7.Structural insights, protein-ligand interactions and spectroscopic characterization of isoformononetin

作者：Anubha Srivastava^a ; ^{anubhaphysics@gmail.com} ; ^{anubha1984@rediffmail.com} ; Harshita Singh^a ; Rashmi Mishra^b ; Kapil Dev^c ; Poonam Tandon^a ; ^{poonam_tandon@yahoo.co.uk} ; ^{poonam_tandon@hotmail.com} ; Rakesh Maurya^c

关键词：Isofomononetin ; FT-Raman ; FT-IR ; NMR ; UV&ndash ; vis spectra ; Molecular docking

刊名：Journal of Molecular Structure

出版年：2017

8.Single-molecule force spectroscopy on polyproteins and receptor-ligand complexes: The current toolbox

作者：Wolfgang Ott^a ; ^b ; ¹ ; Markus A. Jobst^a ; ¹ ; Constantin Schoeler^a ; ¹ ; Hermann E. Gaub^a ; Michael A. Nash^a ; ^c ; ^d ; ^{michael.nash@lmu.de}

关键词：Atomic force microscopy ; Single-molecule force spectroscopy ; Molecular recognition ; Biophysics

刊名：Journal of Structural Biology

出版年：2017

9.Molecular dynamics simulation of the human estrogen receptor alpha: contribution to the pharmacophore of the agonists

作者：Dessislava Jereva^a ; ^{dessislava.jereva@biomed.bas.bg} ; Filip Fratev^a ; ^b ; ^{fratev@biomed.bas.bg} ; Ivanka Tsakovska^a ; ^{itsakovska@biomed.bas.bg} ; Petko Alov^a ; ^{petko.alov@biophys.bas.bg} ; Tania Pencheva^a ; ^{tania.pencheva@biomed.bas.bg} ; Ilza Pajeva^a ; ^{pajeva@biomed.bas.bg}

关键词：Human estrogen receptor alpha ; Agonist ; Pharmacophore ; Molecular dynamics simulation

刊名：Mathematics and Computers in Simulation

出版年：2017

10.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

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