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Determination of interactions between human serum albumin and niraparib through multi-spectroscopic and computational methods 期刊论文
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2019, 卷号: Vol.206, 页码: 126-134
作者:  Gan, Na;  Sun, Qiaomei;  Tang, Peixiao;  Wu, Di;  Xie, Tonghui
收藏  |  浏览/下载：65/0  |  提交时间：2019/02/25
Mixed virtual element methods for elastodynamics with weak symmetry 期刊论文
Journal of Computational and Applied Mathematics, 2019, 卷号: Vol.353, 页码: 49-71
作者:  Baiju Zhang;  Yan Yang;  Minfu Feng
收藏  |  浏览/下载：1/0  |  提交时间：2019/02/25
Four new luminescent-organic frameworks exhibiting highly sensing of nitroaromatics: An experimental and computational insight 期刊论文
Inorganica Chimica Acta, 2019, 卷号: Vol.487, 页码: 257-263
作者:  Lu Lu;  Weicong Liu;  Jun Wang;  Huarui Zhong;  Jianqiang Liu
收藏  |  浏览/下载：9/0  |  提交时间：2019/02/25
Organic Acid-Regulated Lewis Acidity for Selective Catalytic Hydroxymethylfurfural Production from Rice Waste: An Experimental–Computational Study 期刊论文
ACS Sustainable Chemistry & Engineering, 2019, 卷号: Vol.7 No.1, 页码: 1437-1446
作者:  Iris K.M. Yu;  Daniel C.W. Tsang;  Alex C.K. Yip;  Zhishan Su;  Karine De Oliveira Vigier
收藏  |  浏览/下载：11/0  |  提交时间：2019/02/25
Discovery of novel indoleamine 2,3-dioxygenase 1 inhibitors by virtual screening 期刊论文
Computational Biology and Chemistry, 2019, 卷号: Vol.78, 页码: 306-316
作者:  Yeheng Zhou;  Jiale Peng;  Penghua Li;  Haibo Du;  Yaping Li
收藏  |  浏览/下载：23/0  |  提交时间：2019/02/25
Micro-mechanism of the effect of grain size and temperature on the mechanical properties of polycrystalline TiAl 期刊论文
Computational Materials Science, 2019, 卷号: Vol.158, 页码: 76-87
作者:  Jun Ding;  Yu Tian;  Lu-sheng Wang;  Xia Huang;  Hao-ran Zheng
收藏  |  浏览/下载：56/0  |  提交时间：2019/02/28
Effect of precipitate orientation on the twinning deformation in magnesium alloys 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2018, 卷号: Vol.155, 页码: 378-382
作者:  Fan, Haidong;  Zhu, Yaxin;  Wang, Qingyuan
收藏  |  浏览/下载：6/0  |  提交时间：2019/02/25
Interaction mechanism of olaparib binding to human serum albumin investigated with NMR relaxation data and computational methods 期刊论文
RSC ADVANCES, 2018, 卷号: Vol.8 No.55, 页码: 31555-31563
作者:  Zhai, Yuanming;  Deng, Pengchi;  Wang, Xiaoyan;  Zhang, Chunchun;  Gan, Ruixue
收藏  |  浏览/下载：7/0  |  提交时间：2019/02/25
Interface-preserving level set method for simulating dam-break flows 期刊论文
JOURNAL OF COMPUTATIONAL PHYSICS, 2018, 卷号: Vol.374, 页码: 249-280
作者:  Gu, Z. H.;  Wen, H. L.;  Yu, C. H.;  Sheu, Tony W. H.
收藏  |  浏览/下载：3/0  |  提交时间：2019/02/25
A least-squares/fictitious domain method for incompressible viscous flow around obstacles with Navier slip boundary condition 期刊论文
Journal of Computational Physics, 2018, 卷号: Vol.366, 页码: 281-297
作者:  He, QL;  Glowinski, R;  Wang, XP
收藏  |  浏览/下载：14/0  |  提交时间：2019/02/25

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