搜索页_+Theoretical+studies

设为首页

收藏本站

网站地图 | English | 公务邮箱

读者指南

学术客户端

NSTL服务站

科技查新

外文资源

中国地质文献-英文(74)	SpringerLink电子期刊(11371)	GSW全文库(268)
Wiley电子期刊(521)	ProQuest学位论文(3566)	Elsevier电子期刊(20698)
Springer电子图书(35)	NATURE电子期刊(271)	ACS电子期刊(4115)

在“Elsevier电子期刊”中，命中：20,698条，耗时：0.1679176 秒

在所有数据库中总计命中：40,919条

1.Interaction between bioactive compound 11a-N-tosyl-5-deoxi-pterocarpan (LQB-223) and Calf thymus DNA: Spectroscopic approach, electrophoresis and theoretical studies

作者：Marina M. Silva^a ; Eduarda O.O. Nascimento^a ; Edeí ; ldo F. Silva Jú ; nior^a ; Joã ; o Xavier de Araú ; jo Jú ; nior^a ; ^b ; Camilla C. Santana^b ; Luciano Aparecido M. Grillo^b ; Rafaela S. de Oliveira^c ; Paulo R.R.Costa^d ; Camilla D. Buarque^c ; Josué ; Carinhanha C. Santos^a ; ¹ ; ^{josue@iqb.ufal.br} ; ^{jcarinhanha@yahoo.com.br} ; Isis M. Figueiredo^a ; ¹ ; ^{figueiredo.isis@gmail.com}

关键词：11a-N-tosyl-5-carbapterocarpan ; 11a-N-arylsulfonyl-tetrahydro-5H-benzo[a]carbazole ; CT DNA interaction ; Spectroscopic techniques ; Theoretical studies ; Electrophoresis

刊名：International Journal of Biological Macromolecules

出版年：2017

2.Experimental and theoretical investigations on water desalination using direct contact membrane distillation

作者：A. Khalifa^a ; ^{akhalifa@kfupm.edu.sa} ; H. Ahmad^a ; M. Antar^a ; T Laoui^a ; M. Khayet^b ; ^c

关键词：Water desalination ; Direct contact membrane distillation ; Performance investigation ; Experimental and theoretical studies ; Membrane characterization and degradation

刊名：Desalination

出版年：2017

3.Conformational equilibrium of phenylacetic acid and its halogenated analogues through theoretical studies, NMR and IR spectroscopy

作者：Mariana N. Levandowski^a ; Thiago C. Rozada^a ; Ulisses Z. Melo^b ; Ernani A. Basso^b ; Barbara C. Fiorin^a ; ^{bcfiorin@uepg.br}

关键词：Phenylacetic acid ; Conformational analysis ; Theoretical calculations ; Infrared spectroscopy ; NMR spectroscopy

刊名：Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy

出版年：2017

4.Theoretical studies on atmospheric chemistry of HFE-245mc and perfluoro-ethyl formate: Reaction with OH radicals, atmospheric fate of alkoxy radical and global warming potential

作者：Makroni Lily ; Bidisha Baidya ; Asit K. Chandra ; ^{akchandra@nehu.ac.in}

关键词：H-abstraction reactions ; Kinetics ; OH radicals ; Atmospheric lifetime ; Global warming potential

刊名：Chemical Physics Letters

出版年：2017

5.Synthesis, characterization, X-ray structural determination and theoretical study of the complexes [RuCp(8MTT-κS)LL′] (8MTT = 8-methylthio-theophyllinate; L,L′ = PTA, mPTA; L = mPTA, L′ = PPh₃; PTA = 1,3,5-triaza-7-phosphaadamantane, mPTA =

作者：Lazhar Hajji ; Vicente Jara-Pé ; rez ; Cristobal Saraiba-Bello ; Gaspar Segovia-Torrente ; Manuel Serrano-Ruiz ; Antonio Romerosa

关键词：Ruthenium ; Water soluble complexes ; PTA derivatives ; Thio-purines ; Theoretical studies ; DFT

刊名：Inorganica Chimica Acta

出版年：2017

6.Synthesis, characterization and the inhibition activity of a new α-aminophosphonic derivative on the corrosion of XC48 carbon steel in 0.5 M H₂SO₄: Experimental and theoretical studies

作者：Nadjib Chafai^a ; ^b ; ^{n.chafai@univ-skikda.dz} ; ^{nadjib82@gmail.com} ; Salah Chafaa^a ; Khalissa Benbouguerra^a ; Djamel Daoud^a ; ^c ; Abdelkader Hellal^a ; Mouna Mehri^a

关键词：α-aminophosphonic ; Carbon steel ; Corrosion inhibition ; Polarization ; DFT calculation ; Molecular dynamic simulations

刊名：Journal of the Taiwan Institute of Chemical Engineers

出版年：2017

7.Comparison of Propensity Score Methods and Covariate Adjustment: Evaluation in 4 Cardiovascular Studies

作者：Markus C. Elze ; PhD^a ; ^b ; John Gregson ; PhD^a ; Usman Baber ; MD ; PhD^c ; Elizabeth Williamson ; PhD^a ; Samantha Sartori ; PhD^c ; Roxana Mehran ; MD ; PhD^c ; Melissa Nichols ; PhD^d ; ^e ; Gregg W. Stone ; MD ; PhD^d ; ^e ; Stuart J. Pocock ; PhD^a ; ^{stuart.pocock@lshtm.ac.uk}

关键词：bias ; comparison of methods ; observational studies ; regression

刊名：Journal of the American College of Cardiology

出版年：2017

8.Flexural behavior of rectangular FRP-tubes filled with reinforced concrete: Experimental and theoretical studies

作者：Ahmed Abouzied^a ; ^{ahmed.abouzied@usherbrooke.ca} ; Radhouane Masmoudi^b ; ^{radhouane.masmoudi@usherbrooke.ca}

关键词：Beams ; Fiber-reinforced polymer (FRP) ; Concrete filled FRP tubes ; Flexural behavior ; Deflection ; Theoretical predictions

刊名：Engineering Structures

出版年：2017

9.Synthesis, characterization, antimicrobial activity and theoretical studies of new thiophene-based tripodal ligands

作者：Tarik Harit^a ; Reda Bellaouchi^b ; Abdeslam Asehraou^b ; Mahmoud Rahal^c ; ^d ; Ibrahim Bouabdallah^a ; ^e ; Fouad Malek^a ; ^{fouad_malek@yahoo.fr}

关键词：Antimicrobial activity ; Theoretical calculations ; Thiophene ; Tripods

刊名：Journal of Molecular Structure

出版年：2017

10.Structural, quantum chemical, vibrational and thermal studies of a hydrogen bonded zwitterionic co-crystal (nicotinic acid: pyrogallol)

作者：E. Arockia Jeya Yasmi Prabha^a ; S. Suresh Kumar^a ; S. Athimoolam^a ; ^{athi81s@yahoo.co.in} ; B. Sridhar^b

关键词：Nicotinic acid pyrogallol co-crystal ; Structural characteristics ; Vibrational spectral analysis ; DFT studies ; Thermal analysis ; Anti-cancer activity

刊名：Journal of Molecular Structure

出版年：2017

按检索点细分(20698)

题名(1795)

关键词(131)

文摘(15134)

常见问题　|　交通位置　|　联系我们　|　OA远程办公

地址：北京市海淀区学院路29号邮编：100083

电话：办公室：(+86 10)66554848；文献借阅、咨询服务、科技查新：66554700