搜索页_activity relationship (QSAR)

常用资源

电子图书

期刊论文

学位会议

外文资源

特色专题

内部出版物

Wiley电子期刊(27)	ProQuest学位论文(1)	Elsevier电子期刊(1680)
SpringerLink电子期刊(755)	NATURE电子期刊(1)	ACS电子期刊(293)

在“Elsevier电子期刊”中，命中：1,680条，耗时：0.1069424 秒

在所有数据库中总计命中：2,757条

1.Diversity selection, screening and quantitative structure-activity relationships of osmolyte-like additive effects on the thermal stability of a monoclonal antibody

作者：Olubukayo-Opeyemi Oyetayo^a ; ^{oyetayophdhbc@gmail.com} ; Oscar Mé ; ndez-Lucio^b ; Andreas Bender^b ; Hans Kiefer^a

关键词：mAb ; Monoclonal antibody ; MOE ; Molecular Operating Environment ; MDS ; Multi-dimensional scaling ; QSAR ; Quantitative structure&ndash ; activity relationship ; DSC ; Differential scanning calorimetry ; DSF ; Differential scanning fluorimetry ; DMSO ; Dimethyl sulfoxide ; NaOH ; Sodium hydroxide ; HCl ; Hydrochloric acid ; LOO-CV ; Leave-one-out cross-validation ; PCA ; Principal components analysis ; PLS ; Partial least squares ; TMAO ; Trimethylamine N-oxide ; Tm ; Melting temperature ; TS potency ; Thermal stabilization

刊名：European Journal of Pharmaceutical Sciences

出版年：2017

2.An orientation sensitive approach in biomolecule interaction quantitative structure-activity relationship modeling and its application in ion-exchange chromatography

作者：Jö ; rg Kittelmann^a ; Katharina M.H. Lang^a ; Marcel Ottens^b ; Jü ; rgen Hubbuch^a ; ^{Juergen.Hubbuch@kit.edu}

关键词：Quantitative structure&ndash ; activity relationship (QSAR) ; Predictive modeling ; Ion-exchange chromatography ; Binding orientation ; Retention modeling ; Isotherm

刊名：Journal of Chromatography A

出版年：2017

3.Investigation and prediction of protein precipitation by polyethylene glycol using quantitative structure-activity relationship models

作者：Frank Hä ; mmerling ^{frank.haemmerling@kit.edu} ; Christopher Ladd Effio ; Sebastian Andris ; Jö ; rg Kittelmann ; Jü ; rgen Hubbuch ; ^{juergen.hubbuch@kit.edu} ;

关键词：Polyethylene glycol ; Precipitation ; Quantitative structure&ndash ; activity relationship (QSAR) ; Semi-mechanistic modeling ; Monoclonal antibody

刊名：Journal of Biotechnology

出版年：2017

4.Synthesis, evaluation and quantitative structure-activity relationship (QSAR) analysis of Wogonin derivatives as cytotoxic agents

作者：Jinlei Bian¹ ; Tinghan Li¹ ; Tianwei Weng ; Jubo Wang ; Yu Chen ; Zhiyu Li ; ^{zhiyuli@cpu.edu.cn}

关键词：Wogonin ; QSAR ; Cytotoxic ; Flavonoid

刊名：Bioorganic & Medicinal Chemistry Letters

出版年：2017

5.Antitumor activity of 3,4-ethylenedioxythiophene derivatives and quantitative structure-activity relationship analysis

作者：Marijana Jukić^a ; ^{marijanajukic@mefos.hr} ; Vesna Rastija^b ; ^{vrastija@pfos.hr} ; Teuta Opačak-Bernardi^a ; ^{tbernardi@mefos.hr} ; Ivana Stolić^c ; ^{stolic@vef.hr} ; Luka Krstulović^c ; ^{lkrstulovic@vef.hr} ; Miroslav Bajić^c ; ^{mbajic@vef.hr} ; Ljubica Glava&scaron ; -Obrovac^a ; ^{lgobrovac@mefos.hr}

关键词：Antitumor agents ; Heterocycles ; Computational chemistry ; QSAR ; Drug research ; Cell culturing

刊名：Journal of Molecular Structure

出版年：2017

6.QSAR study and molecular docking of benzimidazole derivatives as potent activators of AMP-activated protein kinase

作者：Nidal Naceiri Mrabti^a ; ^{nidal.naceirimrabti@usmba.ac.ma} ; Menana Elhallaoui^b

关键词：REA (relative enzyme activity) ; Benzimidazole derivatives ; Quantitative structure&ndash ; activity relationship (QSAR) ; Multiple linear regression (MLR) ; Neural network (NN) ; Molecular docking

刊名：Journal of Taibah University for Science

出版年：2017

7.Quantitative structure activity relationship study of p38α MAP kinase inhibitors

作者：Eslam Pourbasheer^a ; Sajjad Ahmadpour^b ; Rohollah Zare-Dorabei^c ; Mehdi Nekoei^d ; ^{nekoei_m1@yahoo.com}

关键词：QSAR ; Genetic algorithm ; Stepwise ; Multiple linear regression ; Pyrazole derivative

刊名：Arabian Journal of Chemistry

出版年：2017

8.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

9.Modification of polychlorinated phenols and evaluation of their toxicity, biodegradation and bioconcentration using three-dimensional quantitative structure-activity relationship models

作者：Lidan Tong^a ; Lixin Guo^a ; ^{glx69@163.com} ; Xiaojun Lv^b ; Yu Li^c ; ^{liyuxx8@hotmail.com}

关键词：Pentachlorophenol ; Three-dimensional quantitative structure&ndash ; activity relationship ; Molecular design ; Biotoxicity ; Bioconcentration ; Biodegradation

刊名：Journal of Molecular Graphics and Modelling

出版年：2017

10.Novel anti-tumour barringenol-like triterpenoids from the husks of Xanthoceras sorbifolia Bunge and their three dimensional quantitative structure activity relationships analysis

作者：Da Wang^a ; Dan Su^a ; Bin Yu^a ; Chuming Chen^b ; Li Cheng^a ; Xianzhe Li^a ; Ronggang Xi^c ; Huiyuan Gao^a ; ¹ ; ^{sypugaohy@163.com} ; Xiaobo Wang^c ; ^{wxbbenson0653@163.com}

关键词：Xanthoceras sorbifolia Bunge ; Barrigenol-type triterpenoid ; Antitumor activities ; CoMFA ; CoMSIA ; Health benefits

刊名：Fitoterapia

出版年：2017

按检索点细分(1680)

题名(82)

关键词(236)

文摘(1188)

按出版年细分(1680)

2027年及以后(40)

2017年(27)

2016年(71)

2015年(16)

2014年(1)

2013年(101)

2012年(91)

2011年(74)

2010年(127)

2009年(130)

2008年(127)

2007年(102)

2006年(91)

2005年(96)

2004年(85)

2003年(88)

2002年(70)

2001年(51)

2000年(46)

2000年及以前(246)

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