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浏览/检索结果: 共9条，第1-9条 帮助 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 Phase behaviors of ionic liquids attributed to the dual ionic and organic nature 期刊论文 COMMUNICATIONS IN THEORETICAL PHYSICS, 2022, 卷号: 74, 期号: 9, 页码: 97601 作者:  Tang, Chenyu;  Wang, Yanting 收藏  |  浏览/下载：9/0  |  提交时间：2023/01/16 MOLECULAR-DYNAMICS SIMULATION  COARSE-GRAINED MODELS  AB-INITIO DATA  FORCE-FIELD  NANOSTRUCTURAL ORGANIZATION  SPATIAL HETEROGENEITY  BENZENE MIXTURES  TAIL AGGREGATION  CAR-PARRINELLO  CONFINED WATER   Interplay between binding affinity and kinetics in protein-protein interactions 期刊论文 PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS, 2016 Cao, Huaiqing; Huang, Yongqi; Liu, Zhirong 收藏  |  浏览/下载：5/0  |  提交时间：2017/12/03 intrinsically disordered proteins  protein-protein interaction  binding affinity  coarse-grained model  linear free-energy relationship  INTRINSICALLY DISORDERED PROTEINS  SIDE-CHAIN INTERACTIONS  COARSE-GRAINED MODELS  TRANSITION-STATE  NONNATIVE INTERACTIONS  UNSTRUCTURED PROTEINS  INTERACTION NETWORKS  ENERGY LANDSCAPE  NATIVE TOPOLOGY  FOLDING RATES   Dimensions, energetics, and denaturant effects of the protein unstructured state 期刊论文 PROTEIN SCIENCE, 2016 Li, Maodong; Liu, Zhirong 收藏  |  浏览/下载：5/0  |  提交时间：2017/12/03 protein denaturation  single-molecule FRET  transfer model  binding model  coil-globule transition  SINGLE-MOLECULE SPECTROSCOPY  INTRINSICALLY DISORDERED PROTEINS  TEMPERATURE-INDUCED COLLAPSE  COARSE-GRAINED MODELS  UNFOLDED PROTEINS  GUANIDINE-HYDROCHLORIDE  NONNATIVE INTERACTIONS  UREA  TRANSITION  THERMODYNAMICS   Coarse-grained molecular dynamics analysis of deformation mechanisms of poly(methyl methacrylate) in nanoimprint process 期刊论文 Journal of Computational and Theoretical Nanoscience, 2015, 卷号: 12, 期号: [db:dc_citation_issue], 页码: 3232-3235 作者:  Du, Jun;  Wei, Zhengying 收藏  |  浏览/下载：6/0  |  提交时间：2019/12/02 Coarse grained models  Coarse-grained molecular dynamics  Deformation Characteristics  Deformation mechanism  Molecular dynamics simulations  Nano-imprint  Periodic boundary conditions  Resist deformation   Molecular dynamics calculation of resist deformation behavior in nanoimprint 期刊论文 Gaofenzi Cailiao Kexue Yu Gongcheng/Polymeric Materials Science and Engineering, 2015, 卷号: 31, 期号: [db:dc_citation_issue], 页码: 105-110 作者:  Li, Shize;  Wei, Zhengying;  Du, Jun;  Tang, Yiping;  Chu, Huali 收藏  |  浏览/下载：2/0  |  提交时间：2019/12/02 Calculation models  Coarse-grained molecular dynamics  Coarse-grained molecular dynamics simulations  Molecular dynamics calculation  Nano-imprint  Periodic boundary conditions  Periodic conditions  Resist deformation   Effect of the Chain Length on the Structure of Ionic Liquids: from Spatial Heterogeneity to Ionic Liquid Crystals 期刊论文 JOURNAL OF PHYSICAL CHEMISTRY B, 2013, 卷号: 117, 期号: 4, 页码: 1104-1109 作者:  Wang, YT 收藏  |  浏览/下载：19/0  |  提交时间：2014/04/25 COARSE-GRAINED MODELS  NANOSTRUCTURAL ORGANIZATION  TAIL AGGREGATION  SOLAR-CELLS  DYNAMICS  SALTS  SIMULATION  BEHAVIOR  SYSTEMS   A molecular dynamics simulation of N-(fluorenyl-9-methoxycarbonyl)-dipeptides supramolecular hydrogel 期刊论文 Colloids and Surfaces, A. Physicochemical and Engineering Aspects, 2013, 页码: 217-223 作者:  Heng Zhang;  Hua Wang;  Guiying Xu;  Shiling Yuan 收藏  |  浏览/下载：1/0  |  提交时间：2019/12/23 Coarse grained models  MD simulation  Hydrogel  Fmoc-dipeptides   A molecular dynamics simulation of N-(fluorenyl-9-methoxycarbonyl)-dipeptides supramolecular hydrogel 期刊论文 COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS, 2013, 卷号: 417, 页码: 217-223 作者:  Zhang, Heng;  Wang, Hua;  Xu, Guiying;  Yuan, Shiling 收藏  |  浏览/下载：1/0  |  提交时间：2019/12/23 Coarse grained models  MD simulation  Hydrogel  Fmoc-dipeptides   PACE Force Field for Protein Simulations. 2. Folding Simulations of Peptides 期刊论文 journal of chemical theory and computation, 2010 Han, Wei; Wan, Cheuk-Kin; Wu, Yun-Dong 收藏  |  浏览/下载：3/0  |  提交时间：2015/11/12 MOLECULAR-DYNAMICS SIMULATIONS  FREE-ENERGY LANDSCAPE  TRP-CAGE MINIPROTEIN  GENERALIZED-ENSEMBLE SIMULATIONS  IMMUNOGLOBULIN-BINDING DOMAIN  REPLICA-EXCHANGE SIMULATIONS  ALPHA-HELICAL PEPTIDES  ALANINE-BASED PEPTIDES  COARSE-GRAINED MODELS  BETA-HAIRPIN TRPZIP2