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内部出版物
在“
SpringerLink电子期刊
”中,
命中:
64
条,耗时:小于0.01 秒
1.
Combined 3D-QSAR modeling and molecular docking 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 docking
刊名:Medicinal Chemistry Research
出版年:2017
2.
vSDC: a method to improve early recognition in virtual screening when limited experimental resources are available
作者:
Ludovic Chaput
;
Juan Martinez-Sanz
;
Eric Quiniou…
关键词:
Virtual screening
;
Standard deviation consensus
;
vSDC
;
Gold
;
Glide
;
Surflex
;
FlexX
;
DUD
E ;
Calcineurin
;
Cdk2
刊名:Journal of Cheminformatics
出版年:2016
3.
Comparative evaluation of several docking tools for docking small molecule ligands to DC-SIGN
作者:
Gregor Jug
;
Marko Anderluh
;
Tihomir Toma?i?
关键词:
Antagonists
;
Anti
;
infectives
;
DC
;
SIGN
;
Docking
;
Docking validation
;
HIV
1
刊名:Journal of Molecular Modeling
出版年:2015
4.
Accuracy of the StatStrip versus SureStep
Flexx
glucose meter in neonates at risk of hypoglycemia
作者:
Ratchada Kitsommart (1) (3)
Sopapan Ngerncham (1)
Pimol Wongsiridej (1)
Tharatip Kolatat (1)
Kriang-Sak Jirapaet (1)
Bosco Paes (2)
关键词:
Glucose meter
;
Neonatal hypoglycemia
;
Point
;
of
;
care glucose
刊名:European Journal of Pediatrics
出版年:2013
5.
Comparative molecular docking studies of novel 3, 5-disubstituted thiazolidinedione analogs as HIV-1-RT inhibitors
作者:
Radhe Shyam Bahare (1)
Swastika Ganguly (1)
关键词:
Reverse transcriptase
;
Docking
;
Thiazolidinediones
;
HIV
;
NNRTIs
刊名:Medicinal Chemistry Research
出版年:2014
6.
Virtual screening of imidazole analogs as potential hepatitis C virus NS5B polymerase inhibitors
作者:
Vaishali M. Patil (1)
Satya P. Gupta (2)
Subeer Samanta (3)
Neeraj Masand (4)
关键词:
virtual screening
;
anti
;
HCV
;
NS5B polymerase
;
FlexX
docking
刊名:Chemical Papers
出版年:2013
7.
Identification of novel Interleukin-2 inhibitors through computational approaches
作者:
Sobia Ahsan Halim (1) (2)
Omer Mohamed Abdalla (1) (5)
M. Ahmed Mesaik (1)
Abdul Wadood (1) (3)
Zaheer ul-Haq (1) (4)
Maria Kontoyianni (2)
关键词:
Virtual screening
;
Interleukin
2 ;
GOLD
;
FlexX
;
Glide
;
LigandFit
刊名:Molecular Diversity
出版年:2013
8.
Comparative modeling of Rab6 proteins: identification of key residues and their interactions with guanine nucleotides
作者:
Sandeep Kumar Mulukala Narasimha (1)
Shravan Kumar Gunda (1)
Mahmood Shaik (1)
关键词:
GDP
;
GMP
;
PNP
;
GTP
;
FlexX
;
Modeller9.10
;
Rab6
;
Sybyl
;
Vesicle trafficking
刊名:Journal of Molecular Modeling
出版年:2013
9.
Molecular docking studies for the identification of novel melatoninergic inhibitors for acetylserotonin-O-methyltransferase using different docking routines
作者:
Syed Sikander Azam (1)
Sumra Wajid Abbasi (1)
关键词:
Acetylserotonin
O ;
methyltransferase
;
Bipolar disorders
;
Pineal parenchymal tumors
;
Melatoninergic inhibitors
;
Molecular docking
;
Binding affinities
刊名:Theoretical Biology and Medical Modelling
出版年:2013
10.
Molecular docking studies of novel thiazolidinedione analogs as HIV-1-RT inhibitors
作者:
Swastika Ganguly (1)
Radhe Shyam Bahare (1)
关键词:
Reverse transcriptase
;
Docking
;
Thiazolidinediones
;
HIV
;
NNRTIs
刊名:Medicinal Chemistry Research
出版年:2013
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