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Effective Virtual Screening Strategy toward heme-containing proteins: Identification of novel IDO1 inhibitors 期刊论文
EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, 2019, 卷号: 184, 页码: 23
作者:  Zou, Yi;  Hu, Yue;  Ge, Shushan;  Zheng, Yingbo;  Li, Yuezhen
收藏  |  浏览/下载:34/0  |  提交时间:2020/07/01
KinomeX: a web application for predicting kinome-wide polypharmacology effect of small molecules 期刊论文
BIOINFORMATICS, 2019, 卷号: 35, 期号: 24, 页码: 5354-5356
作者:  Li, Zhaojun;  Li, Xutong;  Liu, Xiaohong;  Fu, Zunyun;  Xiong, Zhaoping
收藏  |  浏览/下载:79/0  |  提交时间:2020/07/01
A Consensus Framework of Distributed Multiple-Tilt Reconstruction in Electron Tomography 期刊论文
JOURNAL OF COMPUTATIONAL BIOLOGY, 2019, 页码: 11
作者:  Wang, Zihao;  Zhang, Jingrong;  Gao, Weifang;  Liu, Zhiyong;  Wan, Xiaohua
收藏  |  浏览/下载:5/0  |  提交时间:2020/12/10
Modeling of atomistic scale shear failure of Ag/MgO interface with misfit dislocation network 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2019, 卷号: 170, 页码: UNSP 109151
作者:  Fu XQ(付雪琼);  Liang LH(梁立红);  Wei YG(魏悦广)
收藏  |  浏览/下载:89/0  |  提交时间:2019/12/17
The scaling limit of high-dimensional online independent component analysis 期刊论文
JOURNAL OF STATISTICAL MECHANICS-THEORY AND EXPERIMENT, 2019, 卷号: 2019, 期号: 12, 页码: 13
作者:  Wang, Chuang;  Lu, Yue M.
收藏  |  浏览/下载:10/0  |  提交时间:2020/03/30
A modular and parallelized watershed modeling framework 期刊论文
ENVIRONMENTAL MODELLING & SOFTWARE, 2019, 卷号: 122, 页码: 16
作者:  Zhu, Liang-Jun;  Liu, Junzhi;  Qin, Cheng-Zhi;  Zhu, A-Xing
收藏  |  浏览/下载:6/0  |  提交时间:2020/05/19
Computational Insight Into the Small Molecule Intervening PD-L1 Dimerization and the Potential Structure-Activity Relationship 期刊论文
FRONTIERS IN CHEMISTRY, 2019, 卷号: 7, 页码: 15
作者:  Shi, Danfeng;  An, Xiaoli;  Bai, Qifeng;  Bing, Zhitong;  Zhou, Shuangyan
收藏  |  浏览/下载:24/0  |  提交时间:2022/01/19
An improved Dai-Kou conjugate gradient algorithm for unconstrained optimization 期刊论文
COMPUTATIONAL OPTIMIZATION AND APPLICATIONS, 2019, 页码: 23
作者:  Liu, Zexian
收藏  |  浏览/下载:158/0  |  提交时间:2020/05/24
Modelling of reactor pressure vessel subjected to pressurized thermal shock using 3D-XFEM 期刊论文
NUCLEAR ENGINEERING AND DESIGN, 2019, 卷号: 353, 页码: 13
作者:  Niceno B;  Jaros M;  Qian GA(钱桂安);  Niffenegger M;  Mora DF
收藏  |  浏览/下载:68/0  |  提交时间:2019/11/26
Tailoring the local lattice distortion of Nd3+ by codoping of Y3+ through first principles calculation for tuning the spectroscopic properties 期刊论文
OPTICAL MATERIALS EXPRESS, 2019, 卷号: 9, 期号: 11, 页码: 4256
作者:  Ma, Fengkai;  Jiang, Dapeng;  Zhang, Zhen;  Tian, Xueqi;  Wu, Qinghui
收藏  |  浏览/下载:94/0  |  提交时间:2019/12/26


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