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青海盐湖研究所 [7]
过程工程研究所 [5]
金属研究所 [1]
数学与系统科学研究院 [1]
上海药物研究所 [1]
天津工业生物技术研究... [1]
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OAI收割 [16]
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期刊论文 [16]
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2023 [1]
2021 [1]
2018 [1]
2017 [2]
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2014 [1]
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LogD7.4 prediction enhanced by transferring knowledge from chromatographic retention time, microscopic pKa and logP
期刊论文
OAI收割
JOURNAL OF CHEMINFORMATICS, 2023, 卷号: 15, 期号: 1, 页码: 13
作者:
Wang, Yitian
;
Xiong, Jiacheng
;
Xiao, Fu
;
Zhang, Wei
;
Cheng, Kaiyang
  |  
收藏
  |  
浏览/下载:43/0
  |  
提交时间:2023/10/17
logD7.4
Lipid solubility
Graph neural network
Molecular property prediction
Machine learning-based solubility prediction and methodology evaluation of active pharmaceutical ingredients in industrial crystallization
期刊论文
OAI收割
FRONTIERS OF CHEMICAL SCIENCE AND ENGINEERING, 2021, 页码: 13
作者:
Ma, Yiming
;
Gao, Zhenguo
;
Shi, Peng
;
Chen, Mingyang
;
Wu, Songgu
  |  
收藏
  |  
浏览/下载:53/0
  |  
提交时间:2022/06/15
solubility prediction
machine learning
artificial neural network
random decision forests
Application of COSMO-RS and UNIFAC for ionic liquids based gas separation
期刊论文
OAI收割
CHEMICAL ENGINEERING SCIENCE, 2018, 卷号: 192, 页码: 816
作者:
Liu, XY
;
Zhou, T
;
Zhang, XP
;
Zhang, SJ
;
Liang, XD
  |  
收藏
  |  
浏览/下载:42/0
  |  
提交时间:2018/12/29
Ionic Liquids (Ils)
Equation-of-state
Cosmo-rs
Extractive Desulfurization
Unifac
Process Simulation
Gas Solubility
Carbon-dioxide
Henry's Law Constant
Co2 Solubility
Binary-systems
Model
Capture
Prediction
Solvents
Ionic Liquid Design and Process Simulation for Decarbonization of Shale Gas
期刊论文
OAI收割
INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, 2017, 卷号: 55, 页码: 5931, 5944
作者:
Liu, XY
;
Huang, Y
;
Zhao, YS
;
Gani, R
;
Zhang, XP
收藏
  |  
浏览/下载:27/0
  |  
提交时间:2017/07/12
PRESSURE PHASE-BEHAVIOR
CARBON-DIOXIDE CAPTURE
ALKYL CHAIN-LENGTH
CO2 CAPTURE
COSMO-RS
DIMETHYL ETHER
NATURAL-GAS
SOLUBILITY
SEPARATION
PREDICTION
Prediction of peanut protein solubility based on the evaluation model established by supervised principal component regression
期刊论文
OAI收割
FOOD CHEMISTRY, 2017, 卷号: 218, 页码: 553-560
作者:
Wang, Li
;
Liu, Hongzhi
;
Liu, Li
;
Wang, Qiang
;
Li, Shurong
  |  
收藏
  |  
浏览/下载:21/0
  |  
提交时间:2018/07/30
Prediction
Peanut protein solubility
Supervised principal component analysis
Evaluation model
Determination and modeling for the solubility of Na2WO4 center dot 2H(2)O and Na2MoO4 center dot 2H(2)O in the (Na+ + MoO42- + WO42- + SO42- + H2O) system
期刊论文
OAI收割
JOURNAL OF CHEMICAL THERMODYNAMICS, 2016, 卷号: 98, 期号: JULY, 页码: 165-172
作者:
Ning, Pengge
;
Xu, Weifeng
;
Cao, Hongbin
;
Xu, Hongbin
收藏
  |  
浏览/下载:17/0
  |  
提交时间:2016/07/15
Solubility
Sodium molybdate
Sodium tungstate
Model parameter
Prediction
Bioinformatics approaches for improved recombinant protein production in Escherichia coli: protein solubility prediction
期刊论文
OAI收割
BRIEFINGS IN BIOINFORMATICS, 2014, 卷号: 15, 期号: 6, 页码: 953-962
作者:
Chang, Catherine Ching Han
;
Song, Jiangning
;
Tey, Beng Ti
;
Ramanan, Ramakrishnan Nagasundara
收藏
  |  
浏览/下载:38/0
  |  
提交时间:2016/06/23
protein solubility
heterologous expression
in silico prediction
intracellular expression
machine learning algorithm
prediction model
Atomic parameter model for the solid solubilities in binary transition metal based alloys
期刊论文
OAI收割
Indian Journal of Physics, 2011, 卷号: 85, 期号: 2, 页码: 261-270
S. Z. Liao
;
H. Y. Zhou
;
Z. A. Zhou
;
H. W. Xie
;
Y. F. Ouyang
;
B. W. Zhang
收藏
  |  
浏览/下载:25/0
  |  
提交时间:2012/04/13
Solid solubility
transition metal
binary alloy
atomic parametric
model
ellipse model
prediction
Prediction of the Solubility of HCl-MgCl(2)-H(2)O System at-5 degrees C Using the Ion-Interaction Model
期刊论文
OAI收割
RUSSIAN JOURNAL OF INORGANIC CHEMISTRY, 2008, 卷号: 53, 期号: 12, 页码: 1967-1971
作者:
Li, Yahong
;
Song, Pengsheng
;
Li, Wu
;
Xia, Shuping
  |  
收藏
  |  
浏览/下载:20/0
  |  
提交时间:2018/06/20
Pitzer Ion-interaction Model
Solubility Prediction
Parameters
Solubility prediction in the ternary systems NaCl-RbCl-H2O, KCl-CsCl-H2O and KBr-CsBr-H2O at 25 degrees C using the ion-interaction model
期刊论文
OAI收割
CALPHAD-COMPUTER COUPLING OF PHASE DIAGRAMS AND THERMOCHEMISTRY, 2007, 卷号: 31, 期号: 4, 页码: 541-544
作者:
Hu, Bin
;
Song, Pengsheng
;
Li, Yahong
;
Li, Wu
  |  
收藏
  |  
浏览/下载:25/0
  |  
提交时间:2018/06/20
Pitzer Ion-interaction Model
Solubility Prediction
Salt Lake Brine