中国科学院机构知识库网格
Chinese Academy of Sciences Institutional Repositories Grid
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CAS IR Grid
机构
上海药物研究所 [5]
中国科学院大学 [2]
上海硅酸盐研究所 [2]
宁波材料技术与工程研... [1]
采集方式
OAI收割 [8]
iSwitch采集 [2]
内容类型
期刊论文 [10]
发表日期
2019 [2]
2018 [1]
2017 [1]
2015 [2]
2014 [1]
2008 [2]
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Deep Neural Network Classifier for Virtual Screening Inhibitors of (S)-Adenosyl-L-Methionine (SAM)-Dependent Methyltransferase Family
期刊论文
OAI收割
FRONTIERS IN CHEMISTRY, 2019, 卷号: 7, 页码: 17
作者:
Li, Fei
;
Wan, Xiaozhe
;
Xing, Jing
;
Tan, Xiaoqin
;
Li, Xutong
  |  
收藏
  |  
浏览/下载:19/0
  |  
提交时间:2020/07/01
deep neural network
virtual screening
methyltransferase
epigenetic
drug design
Investigation of mechanical and thermal properties of rare earth pyrochlore oxides by first-principles calculations
期刊论文
OAI收割
JOURNAL OF THE AMERICAN CERAMIC SOCIETY, 2019, 卷号: 102, 期号: 5, 页码: 2830
作者:
Yang, Lan
;
Zhu, Changhua
;
Sheng, Ye
;
Nian, Hongqiang
;
Li, Qian
  |  
收藏
  |  
浏览/下载:100/0
  |  
提交时间:2019/12/26
first-principles calculations
mechanical properties
pyrochlore
thermal conductivity
Discovery of 1,8-acridinedione derivatives as novel GCN5 inhibitors via high throughput screening
期刊论文
OAI收割
EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, 2018, 卷号: 151, 页码: 740-751
作者:
Xiong, Huan
;
Han, Jie
;
Wang, Jun
;
Lu, Wenchao
;
Wang, Chen
  |  
收藏
  |  
浏览/下载:39/0
  |  
提交时间:2019/01/08
Epigenetics
Histone acetyltransferase
GCN5
High throughput screening
1,8-Acridinedione derivative
Electrolyte-controlled discharge product distribution of Na-O-2 batteries: a combined computational and experimental study
期刊论文
OAI收割
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2017, 卷号: 19, 期号: 4, 页码: 2940-2949
作者:
Wang, Beizhou
;
Zhao, Ning
;
Wang, Youwei
;
Zhang, Wenqing
;
Lu, Wencong
收藏
  |  
浏览/下载:31/0
  |  
提交时间:2017/04/13
Discovery and Optimization of Novel, Selective Histone Methyltransferase SET7 Inhibitors by Pharmacophore- and Docking-Based Virtual Screening
期刊论文
OAI收割
JOURNAL OF MEDICINAL CHEMISTRY, 2015, 卷号: 58, 期号: 20, 页码: 8166-8181
作者:
Meng, Fanwang
;
Cheng, Sufang
;
Ding, Hong
;
Liu, Shien
;
Liu, Yan
  |  
收藏
  |  
浏览/下载:40/0
  |  
提交时间:2019/01/08
Preparation and Properties of Superhydrophobizted Sprayed Zn-Al Coating
期刊论文
OAI收割
Chinese Journal of Materials Research, 2015, 卷号: 29, 期号: 7, 页码: 523-528
Sun Xiaodong
;
Liu Gang
;
Li Longyang
;
Liu Eryong
;
Lu Wencong
;
Zeng Zhixiang
;
Wu Xuedong
收藏
  |  
浏览/下载:19/0
  |  
提交时间:2016/09/18
Predicting network of drug-enzyme interaction based on machine learning method
期刊论文
OAI收割
BIOCHIMICA ET BIOPHYSICA ACTA-PROTEINS AND PROTEOMICS, 2014, 卷号: 1844, 期号: 1, 页码: 214-223
作者:
Niu, Bing
;
Zhang, Yuchao
;
Ding, Juan
;
Lu, Yin
;
Wang, Miao
  |  
收藏
  |  
浏览/下载:18/0
  |  
提交时间:2019/01/08
Drug-enzyme interaction
CfsSubset
Machine learning
Random Forest
Pseudo amino acid composition
Molecular descriptor
Prediction of peptidase category based on functional domain composition
期刊论文
iSwitch采集
Journal of proteome research, 2008, 卷号: 7, 期号: 10, 页码: 4521-4524
作者:
Xu, XiaoChun
;
Yu, Dong
;
Fang, Wei
;
Cheng, Yushao
;
Qian, Ziliang
收藏
  |  
浏览/下载:17/0
  |  
提交时间:2019/05/10
Peptidases
The nearest neighbor algorithm
Blast
Functional domain composition
Prediction of membrane protein types in a hybrid space
期刊论文
iSwitch采集
Journal of proteome research, 2008, 卷号: 7, 期号: 3, 页码: 1131-1137
作者:
Jia, Peilin
;
Qian, Ziliang
;
Feng, Kaiyan
;
Lu, Wencong
;
Li, Yixue
收藏
  |  
浏览/下载:42/0
  |  
提交时间:2019/05/10
Membrane protein
Nearest neighbor algorithm
Feature selection
usingsupportvectorclassificationforsaroffentanylderivatives
期刊论文
OAI收割
actapharmacologicasinica, 2005, 卷号: 26, 期号: 1, 页码: 107
作者:
Nianyi CHEN
;
Youcheng ZHU
;
Kaixian CHEN
;
Ning DONG
;
Wencong Lu
  |  
收藏
  |  
浏览/下载:11/0
  |  
提交时间:2020/07/01
MACHINES
structure-activity relationship
support vector machine
fentanyl derivatives
support vector classification