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浏览/检索结果: 共12条，第1-10条 帮助 限定条件 发表日期：2017    专题：上海药物研究所    第一署名单位    第一作者单位    通讯作者单位     已选(0)清除 条数/页：5101520253035404550556065707580859095100   排序方式：请选择作者升序作者降序题名升序题名降序发表日期升序发表日期降序提交时间升序提交时间降序 Conformation and dynamics of the C-terminal region in human phosphoglycerate mutase 1 期刊论文 ACTA PHARMACOLOGICA SINICA, 2017, 卷号: 38, 期号: 12, 页码: 1673-1682 作者:  Liu, Shi-en;  Hu, Jun-chi;  Zhang, Hao;  Xu, Pan;  Wan, Wei 收藏  |  浏览/下载：19/0  |  提交时间：2019/01/08 phosphoglycerate mutase 1 (PGAM1)  human cancers  metabolic target  C-terminal region  conformational changes  molecular dynamics simulation   Structure, physicochemical properties and pharmacokinetics of resveratrol and piperine cocrystals 期刊论文 CRYSTENGCOMM, 2017, 卷号: 19, 期号: 41, 页码: 6154-6163 作者:  He, Hongyan;  Zhang, Qi;  Wang, Jian-Rong;  Mei, Xuefeng 收藏  |  浏览/下载：14/0  |  提交时间：2019/01/08 Cyanobacterial peptides as a prototype for the design of cathepsin D inhibitors 期刊论文 JOURNAL OF PEPTIDE SCIENCE, 2017, 卷号: 23, 期号: 9, 页码: 701-706 作者:  Xu, Hao;  Bao, Keting;  Tang, Shuai;  Ai, Jing;  Hu, Haiyan 收藏  |  浏览/下载：26/0  |  提交时间：2019/01/08 cathepsin D  inhibitor  peptides  structural modification  transition-state mimics   Effective Conformational Sampling in Explicit Solvent with Gaussian Biased Accelerated Molecular Dynamics 期刊论文 JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2017, 卷号: 13, 期号: 9, 页码: 4240-4252 作者:  Shao, Qiang;  Zhu, Weiliang 收藏  |  浏览/下载：6/0  |  提交时间：2019/01/08 Deconvoluting AMP-activated protein kinase (AMPK) adenine nucleotide binding and sensing 期刊论文 JOURNAL OF BIOLOGICAL CHEMISTRY, 2017, 卷号: 292, 期号: 30, 页码: 12653-12666 作者:  Gu, Xin;  Yan, Yan;  Novick, Scott J.;  Kovach, Amanda;  Goswami, Devrishi 收藏  |  浏览/下载：21/0  |  提交时间：2019/01/08 AMP  AMP-activated kinase (AMPK)  ATP  energy metabolism  protein kinase  CBS  HDX-MS  NADPH   Docking-based structural splicing and reassembly strategy to develop novel deazapurine derivatives as potent B-Raf(V600E) inhibitors 期刊论文 ACTA PHARMACOLOGICA SINICA, 2017, 卷号: 38, 期号: 7, 页码: 1059-1068 作者:  Wang, Gui-min;  Wang, Xiang;  Zhu, Jian-ming;  Guo, Bin-bin;  Yang, Zhuo 收藏  |  浏览/下载：17/0  |  提交时间：2019/01/08 B-Raf(V600E) inhibitor  anticancer  vemurafenib  deazapurine  fragment reassembly  molecular docking  structure-activity relationship   Discovery and optimization of selective inhibitors of protein arginine methyltransferase 5 by docking-based virtual screening 期刊论文 ORGANIC & BIOMOLECULAR CHEMISTRY, 2017, 卷号: 15, 期号: 17, 页码: 3648-3661 作者:  Ye, Yan;  Zhang, Bidong;  Mao, Ruifeng;  Zhang, Chenhua;  Wang, Yulan 收藏  |  浏览/下载：22/0  |  提交时间：2019/01/08 In Situ Monitoring Intracellular Structural Change of Nanovehicles through Photoacoustic Signals Based on Phenylboronate-Linked RGD-Dextran/Purpurin 18 Conjugates 期刊论文 BIOMACROMOLECULES, 2017, 卷号: 18, 期号: 4, 页码: 1249-1258 作者:  Cheng, Dong-Bing;  Qi, Guo-Bin;  Wang, Jing-Qi;  Gong, Yong;  Liu, Fu-Hua 收藏  |  浏览/下载：13/0  |  提交时间：2019/01/08 The profiling of the metabolites of hirsutine in rat by ultra-high performance liquid chromatography coupled with linear ion trap Orbitrap mass spectrometry: An improved strategy for the systematic screening and identification of metabolites in multi-samples in vivo 期刊论文 JOURNAL OF PHARMACEUTICAL AND BIOMEDICAL ANALYSIS, 2017, 卷号: 134, 页码: 149-157 作者:  Wang, Jianwei;  Qi, Peng;  Hou, Jinjun;  Shen, Yao;  Yang, Min 收藏  |  浏览/下载：30/0  |  提交时间：2019/01/08 Hirsutine  Metabolic profile  Multi-samples  Metabolites systematic screening  Uncaria rhynchophylla  UHPLC/LTQ-Orbitrap-MS   Energetics and structural characterization of the "DFG-flip'' conformational transition of B-RAF kinase: a SITS molecular dynamics study 期刊论文 PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2017, 卷号: 19, 期号: 2, 页码: 1257-1267 作者:  Shao, Qiang;  Xu, Zhijian;  Wang, Jinan;  Shi, Jiye;  Zhu, Weiliang 收藏  |  浏览/下载：17/0  |  提交时间：2019/01/08