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In silico prediction of metabolic stability for ester-containing molecules: Machine learning and quantum mechanical methods
Journal article
Deng, Shiwei, Wu, Yiyang, Ye, Zhuyifan, Ouyang, Defang. In silico prediction of metabolic stability for ester-containing molecules: Machine learning and quantum mechanical methods[J]. Chemometrics and Intelligent Laboratory Systems, 2025, 257, 105292.
Authors:
Deng, Shiwei
;
Wu, Yiyang
;
Ye, Zhuyifan
;
Ouyang, Defang
Favorite
|
TC[Scopus]:
0
IF:
3.7
/
3.7
|
Submit date:2025/01/22
Carboxylic Ester
Machine Learning
Pharmacokinetics
Metabolic Stability
Chemometrics
Quantum Mechanics
Weak-Coordination Electrolyte Enabling Fast Li+ Transport in Lithium Metal Batteries at Ultra-Low Temperature
Journal article
Lin, Wang, Li, Jidao, Wang, Jingshu, Gu, Kecheng, Li, Heng, Xu, Zhu, Wang, Kexuan, Wang, Feng, Zhu, Mengyu, Fan, You, Wang, Huibo, Tao, Guangjian, Liu, Na, Ding, Maofeng, Chen, Shi, Wu, Jiang, Tang, Yuxin. Weak-Coordination Electrolyte Enabling Fast Li+ Transport in Lithium Metal Batteries at Ultra-Low Temperature[J]. Small, 2023, 19(23), 2207093.
Authors:
Lin, Wang
;
Li, Jidao
;
Wang, Jingshu
;
Gu, Kecheng
;
Li, Heng
; et al.
Favorite
|
TC[WOS]:
19
TC[Scopus]:
19
IF:
13.0
/
13.5
|
Submit date:2023/07/19
Binding Energy
Carboxylic Ester
Electrolytes
Lithium Metal Batteries
Low Temperature
Solvation Structures
Chikusetsusaponin IVa methyl ester induces G1 cell cycle arrest, triggers apoptosis and inhibits migration and invasion in ovarian cancer cells
Journal article
Chen, Xin, Wu, Qiu-Shuang, Meng, Fan-Cheng, Tang, Zheng-Hai, Chen, Xiuping, Lin, Li-Gen, Chen, Ping, Qiang, Wen-An, Wang, Yi-Tao, Zhang, Qing-Wen, Lu, Jin-Jian. Chikusetsusaponin IVa methyl ester induces G1 cell cycle arrest, triggers apoptosis and inhibits migration and invasion in ovarian cancer cells[J]. PHYTOMEDICINE, 2017, 29(13), 1555-1565.
Authors:
Chen, Xin
;
Wu, Qiu-Shuang
;
Meng, Fan-Cheng
;
Tang, Zheng-Hai
;
Chen, Xiuping
; et al.
Favorite
|
TC[WOS]:
36
TC[Scopus]:
33
IF:
6.7
/
6.2
|
Submit date:2018/10/30
Panacis Japonici Rhizoma
Chikusetsusaponin Iva Methyl Ester
Ovarian Cancer
Cell Cycle Arrest
Apoptosis
Metastasis
Chikusetsusaponin IVa Methyl Ester Induces G1 Cell Cycle Arrest, Triggers Apoptosis and Inhibits Migration and Invasion on Ovarian Cancer Cells
Conference paper
Chen, X, Wu, QS, Meng, FC, Tang, ZH, Chen, X. P., Lin, L., Chen, P, Wang, Y. T., Zhang, Q. W., Lu, J.. Chikusetsusaponin IVa Methyl Ester Induces G1 Cell Cycle Arrest, Triggers Apoptosis and Inhibits Migration and Invasion on Ovarian Cancer Cells[C], 2016.
Authors:
Chen, X
;
Wu, QS
;
Meng, FC
;
Tang, ZH
;
Chen, X. P.
; et al.
Favorite
|
|
Submit date:2022/07/27
Panacis Japonici Rhizoma
Chikusetsusaponin IVa methyl ester
ovarian cancer
cell cycle arrest
apoptosis
metastasis
Transport and metabolism of (+/-)-praeruptorin A in Caco-2 cell monolayers
Journal article
Jing, W. H., Song, Y. L., Yan, R., Bi, H. C., Li, P. T., Wang, Y. T.. Transport and metabolism of (+/-)-praeruptorin A in Caco-2 cell monolayers[J]. XENOBIOTICA, 2011, 41(1), 71-81.
Authors:
Jing, W. H.
;
Song, Y. L.
;
Yan, R.
;
Bi, H. C.
;
Li, P. T.
; et al.
Favorite
|
TC[WOS]:
20
TC[Scopus]:
21
IF:
1.3
/
1.4
|
Submit date:2018/11/01
Intestinal-absorption
Gene-expression
Drug Transport
Human Liver
Permeability
Carboxylesterases
Enantiomers
Ester