Extended ensemble framework for tranferable coarse-grained potentials

被引：0
|
作者：
Mullinax, J. W. [1 ]
Noid, W. G. [1 ]
机构：
[1] Penn State Univ, Dept Chem, University Pk, PA 16802 USA
来源：
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY | 2009年 / 238卷
关键词：
D O I：
暂无
中图分类号：
O6 [化学];
学科分类号：
0703 ;
摘要：
448-PHYS
引用
收藏
页数：1
相关论文
共 50 条
  • [21] Coarse-grained potentials of single-walled carbon nanotubes
    Zhao, Junhua
    Jiang, Jin-Wu
    Wang, Lifeng
    Guo, Wanlin
    Rabczuk, Timon
    Journal of the Mechanics and Physics of Solids, 2014, 71 (01) : 197 - 218
  • [22] Dynamics and thermodynamics of the coronene octamer described by coarse-grained potentials
    Hernandez-Rojas, J.
    Calvo, F.
    Niblett, S.
    Wales, D. J.
    PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2017, 19 (03) : 1884 - 1895
  • [23] Determination of Protein Coarse-Grained Potentials by Machine Learning Approaches
    Vazquez, Eric
    Thomas, Rachel
    Zamora-Resendiz, Rafael
    Tang, Yu-Hang
    Watanabe, Masakatsu
    Crivelli, Silvia
    BIOPHYSICAL JOURNAL, 2020, 118 (03) : 180A - 180A
  • [24] Coarse-Grained Modeling of Soft Materials by using Transient Potentials
    Uneyama T.
    Zairyo/Journal of the Society of Materials Science, Japan, 2022, 71 (08) : 666 - 671
  • [25] Coarse-grained potentials of single-walled carbon nanotubes
    Zhao, Junhua
    Jiang, Jin-Wu
    Wang, Lifeng
    Guo, Wanlin
    Rabczuk, Timon
    JOURNAL OF THE MECHANICS AND PHYSICS OF SOLIDS, 2014, 71 : 197 - 218
  • [26] Improved Angle Potentials for Coarse-Grained Molecular Dynamics Simulations
    Bulacu, Monica
    Goga, Nicolae
    Zhao, Wei
    Rossi, Giulia
    Monticelli, Luca
    Periole, Xavier
    Tieleman, D. Peter
    Marrink, Siewert J.
    JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2013, 9 (08) : 3282 - 3292
  • [27] Extended Detrended Fluctuation Analysis of Coarse-Grained Time Series
    Koronovskii, Alexander A.
    Blokhina, Inna A.
    Dmitrenko, Alexander, V
    Tuzhilkin, Matvey A.
    Moiseikina, Tatyana, V
    Elizarova, Inna, V
    Semyachkina-Glushkovskaya, Oxana, V
    Pavlov, Alexey N.
    DIAGNOSTICS, 2023, 13 (01)
  • [28] Coarse-Grained Localization: Extended Analyses and Optimal Beacon Distribution
    Salomon, Ralf
    Blumenthal, Jan
    ETFA 2005: 10TH IEEE INTERNATIONAL CONFERENCE ON EMERGING TECHNOLOGIES AND FACTORY AUTOMATION, VOL 2, PROCEEDINGS, 2005,
  • [29] Coarse-Grained Transactions
    Koskinen, Eric
    Parkinson, Matthew
    Herlihy, Maurice
    ACM SIGPLAN NOTICES, 2010, 45 (01) : 19 - 30
  • [30] Coarse-Grained Transactions
    Koskinen, Eric
    Parkinson, Matthew
    Herlihy, Maurice
    POPL'10: PROCEEDINGS OF THE 37TH ANNUAL ACM SIGPLAN-SIGACT SYMPOSIUM ON PRINCIPLES OF PROGRAMMING LANGUAGES, 2010, : 19 - 30
12345