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科研机构
大连理工大学 [5]
内容类型
期刊论文 [5]
发表日期
2014 [5]
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发表日期:2014
专题:大连理工大学
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SABRE: Ligand/Structure-Based Virtual Screening Approach Using Consensus Molecular-Shape Pattern Recognition
期刊论文
JOURNAL OF CHEMICAL INFORMATION AND MODELING, 2014, 卷号: 54, 页码: 338-346
作者:
Wei, Ning-Ning
;
Hamza, Adel
收藏
  |  
浏览/下载:7/0
  |  
提交时间:2019/12/09
Active compounds
Binding pockets
Chemical similarity
Linear combinations
Molecular shapes
Receptor binding site
Structural diversity
Virtual Screening, Algorithms
Binding sites
Data fusion
Ligands
Molecules
Pattern recognition, Three dimensional, ligand
protein, algorithm
automated pattern recognition
binding site
biology
chemical database
chemical structure
chemical structure
chemistry
computer interface
computer program
drug database
drug development
drug screening
human
metabolism
procedures
statistics and numerical data
validation study, Algorithms
Binding Sites
Computational Biology
Databases, Chemical
Databases, Pharmaceutical
Drug Discovery
Drug Evaluation, Preclinical
Humans
Ligands
Models, Molecular
Molecular Structure
Pattern Recognition, Automated
Proteins
Software
User-Computer Interface
Numerical modeling of carrier gas flow in atomic layer deposition vacuum reactor: A comparative study of lattice Boltzmann models
期刊论文
JOURNAL OF VACUUM SCIENCE & TECHNOLOGY A, 2014, 卷号: 32
作者:
Pan, Dongqing
;
Li, Tao
;
Jen, Tien Chien
;
Yuan, Chris
收藏
  |  
浏览/下载:2/0
  |  
提交时间:2019/12/09
An improved coupling of numerical and physical models for simulating wave propagation
期刊论文
CHINA OCEAN ENGINEERING, 2014, 卷号: 28, 页码: 1-16
作者:
Yang Zhi-wen
;
Liu Shu-xue
;
Li Jin-xuan
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2019/12/09
coupling
numerical model
physical model
wave propagation
transfer function modulation
Experimental and Numerical Assessment of Restrained Shrinkage Cracking of Concrete Using Elliptical Ring Specimens
期刊论文
JOURNAL OF MATERIALS IN CIVIL ENGINEERING, 2014, 卷号: 26
作者:
Zhou, Xiangming
;
Dong, Wei
;
Oladiran, Olayinka
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2019/12/09
Concrete
Cracking
Fracture
Geometry
Numerical models
Rings
Shrinkage
Stress concentration
Structural analysis
Thermal analysis
A comparative study of viscoelastic planar contraction flow for polymer melts using molecular constitutive models
期刊论文
KOREA-AUSTRALIA RHEOLOGY JOURNAL, 2014, 卷号: 26, 页码: 365-375
作者:
Wang, Wei
;
Wang, Xuanping
;
Hu, Changxu
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2019/12/09
numerical simulation
planar contraction flow
viscoelastic constitutive model
rheological behavior
polymer melts
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