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内部出版物
在“
SpringerLink电子期刊
”中，
命中：
4,565
条，耗时：小于0.01 秒
1.
Molecular
Dock
ing, Molecular Dynamics Simulations, Computational Screening to Design Quorum Sensing Inhibitors Targeting LuxP of
Vibrio harveyi
and Its Biological Evaluation
作者：
Sundaraj Rajamanikandan
;
Jeyaraman Jeyakanthan…
关键词：
Quorum sensing
;
Boronic acid derivatives
;
Molecular
dock
ing
;
Molecular dynamics simulations
;
In vitro assays
刊名：Applied Biochemistry and Biotechnology
出版年：2017
2.
Synthesis,
in vitro
anti-inflammatory activity and molecular
dock
ing studies of novel 4,5-diarylthiophene-2-carboxamide derivatives
作者：
T SHANMUGANATHAN
;
K PARTHASARATHY
;
M VENUGOPAL
;
Y ARUN…
关键词：
Demethylation
45 ;
diarylthiophene
2 ;
carboxamide derivatives
;
anti
;
inflammatory
;
molecular
dock
ing
刊名：Journal of Chemical Sciences
出版年：2017
3.
Mechanism and Nature of Inhibition of Trypsin by Ligupurpuroside A, a Ku-Ding Tea Extract, Studied by Spectroscopic and
Dock
ing Methods
作者：
Zhibing Wu
;
Liangliang Shen
;
Qingguo Han
;
Jun Lu
;
Haifeng Tang
;
Xu Xu…
关键词：
Dock
ing
;
Ku
;
Ding tea
;
Ligupurpuroside A
;
Spectroscopy
;
Trypsin
刊名：Food Biophysics
出版年：2017
4.
Pharmacoinformatics and molecular
dock
ing studies reveal potential novel Proline Dehydrogenase (PRODH) compounds for Schizophrenia inhibition
作者：
Sheikh Arslan Sehgal
关键词：
Schizophrenia
;
Pharmacophore identification
;
Structure prediction and molecular
Dock
ing
;
PRODH
;
Virtual screening
;
Computer
;
aided drug designing
刊名：Medicinal Chemistry Research
出版年：2017
5.
Inhibition of pro-/active MMP-2 by green tea catechins and prediction of their interaction by molecular
dock
ing studies
作者：
Animesh Chowdhury
;
Suman Kumar Nandy…
关键词：
MMP
2 ;
proMMP
2 ;
MT1
;
MMP
;
Green tea catechin
;
PASMC
;
Molecular
dock
ing analysis
刊名：Molecular and Cellular Biochemistry
出版年：2017
6.
Binding of anti-
Trypanosoma
natural products from African flora against selected drug targets: a
dock
ing study
作者：
Akachukwu Ibezim
;
Biplab Debnath
;
Fidele Ntie-Kang…
关键词：
African flora
;
Dock
ing
;
Drug
;
likeness
;
Drug targets
;
in silico
;
Trypanosomiasis
刊名：Medicinal Chemistry Research
出版年：2017
7.
Synthesis, characterization, preliminary SAR and molecular
dock
ing study of some novel substituted imidazo[2,1-
b
][1,3,4]thiadiazole derivatives as antifungal agents
作者：
Mustafa Er
;
Buğracan Ergüven
;
Hakan Tahtaci…
关键词：2 ;
Amino
;
[1
3 ;
4]thiadiazole
;
Imidazo[2
1 ;
b][1
3 ;
4]thiadiazole
;
Phenacyl bromide
;
Molecular
dock
ing
;
Antifungal activity
;
SAR
刊名：Medicinal Chemistry Research
出版年：2017
8.
Interaction mechanism of pepsin with a natural inhibitor gastrodin studied by spectroscopic methods and molecular
dock
ing
作者：
Jie Wang
;
Calvin Chan
;
Feng-wen Huang
;
Jiang-feng Xie…
关键词：
Gastrodin
;
Pepsin
;
Fluorescence spectra
;
Static quenching
;
Protein–ligand
dock
ing
刊名：Medicinal Chemistry Research
出版年：2017
9.
Combined 3D-QSAR modeling and molecular
dock
ing study on spiro-derivatives as inhibitors of acetyl-CoA carboxylase
作者：
Jian Gao
;
Jie Sun
;
Tao Wang
;
Shen Sheng
;
Tonghui Huang
关键词：
Acetyl
;
CoA carboxylase
;
3D
;
QSAR
;
CoMFA
;
CoMSIA
;
Molecular
dock
ing
刊名：Medicinal Chemistry Research
出版年：2017
10.
In vitro monoamine oxidase A and B inhibitory activity and molecular
dock
ing simulations of fucoxanthin
作者：
Hyun Ah Jung
;
Anupom Roy
;
Jae Sue Choi
关键词：
Fucoxanthin
;
Monoamine oxidase
;
Kinetic
;
Dock
ing
;
Parkinson’s disease
刊名：Fisheries Science
出版年：2017
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