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CORC

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Molecular docking, binding free energy analysis, and biological evaluation of bisabolonalone hydrazone carboxamides as H+,K+-ATPase reversible inhibitors 期刊论文
MEDICINAL CHEMISTRY RESEARCH, 2018, 卷号: 27, 期号: 1, 页码: 332-340
作者:  She, Xin-Xin;  Dong, Qing;  Luo, Hua-Jun;  Wang, Jun-Zhi;  Huang, Nian-Yu
收藏  |  浏览/下载：47/0  |  提交时间：2019/06/20
Computational Studies on Acetylcholinesterases 期刊论文
MOLECULES, 2017, 卷号: 22, 期号: 8
作者:  Xu, Yechun;  Cheng, Shanmei;  Sussman, Joel L.;  Silman, Israel;  Jiang, Hualiang
收藏  |  浏览/下载：17/0  |  提交时间：2019/01/08
Computational insights into the interaction mechanism of triazolyl substituted tetrahydrobenzofuran derivatives with H+,K+-ATPase at different pH 期刊论文
JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN, 2016, 卷号: 30, 期号: 1, 页码: 27-37
作者:  Luo, Hua-Jun;  Wang, Jun-Zhi;  Huang, Nian-Yu;  Deng, Wei-Qiao;  Zou, Kun
收藏  |  浏览/下载：16/0  |  提交时间：2019/06/20
Comparison of Three Molecular Simulation Approaches for Cyclodextrin-Ibuprofen Complexation 期刊论文
JOURNAL OF NANOMATERIALS, 2015
作者:  Wang, Runmiao;  Zhou, Hui;  Siu, Shirley W. I.;  Gan, Yong;  Wang, Yitao
收藏  |  浏览/下载：10/0  |  提交时间：2019/01/08
QM/MM study on the catalytic mechanism of cyclohexane-1,2-dione hydrolase (CDH) 期刊论文
THEORETICAL CHEMISTRY ACCOUNTS, Zhu, WY; Liu, YJ.QM/MM study on the catalytic mechanism of cyclohexane-1,2-dione hydrolase (CDH),THEORETICAL CHEMISTRY ACCOUNTS,2013,133(2):, 2013
Zhu, Wenyou; Liu, Yongjun; Liu, YJ (reprint author), Shandong Univ, Sch Chem & Chem Engn, Key Lab Colloid & Interface Chem, Minist Educ, Jinan 250100, Shandong, Peoples R China.
收藏  |  浏览/下载：19/0  |  提交时间：2019/06/14
QM/MM study on the catalytic mechanism of cyclohexane-1,2-dione hydrolase (CDH) 期刊论文
THEORETICAL CHEMISTRY ACCOUNTS, Zhu, WY; Liu, YJ.QM/MM study on the catalytic mechanism of cyclohexane-1,2-dione hydrolase (CDH),THEORETICAL CHEMISTRY ACCOUNTS,2013,133(2):, 2013
Zhu, Wenyou; Liu, Yongjun; Liu, YJ (reprint author), Shandong Univ, Sch Chem & Chem Engn, Key Lab Colloid & Interface Chem, Minist Educ, Jinan 250100, Shandong, Peoples R China.
收藏  |  浏览/下载：21/0  |  提交时间：2019/06/28
QM/MM study on the catalytic mechanism of cyclohexane-1,2-dione hydrolase (CDH) 期刊论文
THEORETICAL CHEMISTRY ACCOUNTS, Zhu, WY; Liu, YJ.QM/MM study on the catalytic mechanism of cyclohexane-1,2-dione hydrolase (CDH),THEORETICAL CHEMISTRY ACCOUNTS,2013,133(2):, 2013
Zhu, Wenyou; Liu, Yongjun; Liu, YJ (reprint author), Shandong Univ, Sch Chem & Chem Engn, Key Lab Colloid & Interface Chem, Minist Educ, Jinan 250100, Shandong, Peoples R China.
收藏  |  浏览/下载：19/0  |  提交时间：2019/06/21
QM/MM study on the catalytic mechanism of cyclohexane-1,2-dione hydrolase (CDH) 期刊论文
THEORETICAL CHEMISTRY ACCOUNTS, Zhu, WY; Liu, YJ.QM/MM study on the catalytic mechanism of cyclohexane-1,2-dione hydrolase (CDH),THEORETICAL CHEMISTRY ACCOUNTS,2013,133(2):, 2013
Zhu, Wenyou; Liu, Yongjun; Liu, YJ (reprint author), Shandong Univ, Sch Chem & Chem Engn, Key Lab Colloid & Interface Chem, Minist Educ, Jinan 250100, Shandong, Peoples R China.
收藏  |  浏览/下载：18/0  |  提交时间：2019/07/12
QM/MM study on the catalytic mechanism of cyclohexane-1,2-dione hydrolase (CDH) 期刊论文
THEORETICAL CHEMISTRY ACCOUNTS, Zhu, WY; Liu, YJ.QM/MM study on the catalytic mechanism of cyclohexane-1,2-dione hydrolase (CDH),THEORETICAL CHEMISTRY ACCOUNTS,2013,133(2):, 2013
Zhu, Wenyou; Liu, Yongjun; Liu, YJ (reprint author), Shandong Univ, Sch Chem & Chem Engn, Key Lab Colloid & Interface Chem, Minist Educ, Jinan 250100, Shandong, Peoples R China.
收藏  |  浏览/下载：18/0  |  提交时间：2019/07/05
QM/MM study on the catalytic mechanism of cyclohexane-1,2-dione hydrolase (CDH) 期刊论文
THEORETICAL CHEMISTRY ACCOUNTS, Zhu, WY; Liu, YJ.QM/MM study on the catalytic mechanism of cyclohexane-1,2-dione hydrolase (CDH),THEORETICAL CHEMISTRY ACCOUNTS,2013,133(2):, 2013
Zhu, Wenyou; Liu, Yongjun; Liu, YJ (reprint author), Shandong Univ, Sch Chem & Chem Engn, Key Lab Colloid & Interface Chem, Minist Educ, Jinan 250100, Shandong, Peoples R China.
收藏  |  浏览/下载：17/0  |  提交时间：2019/08/02

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