Coarse-grained and multiscale models of bulk liquids and macromolecules

被引:0
|
作者
Head-Gordon, Teresa [1 ]
机构
[1] Univ Calif Berkeley, Dept Bioengn, Berkeley, CA 94720 USA
关键词
D O I
暂无
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
97-COMP
引用
收藏
页数:1
相关论文
共 50 条
  • [41] Coarse-grained modeling of peptide assembly in bulk and at interfaces
    Shell, M. Scott
    [J]. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2019, 257
  • [42] DESIGN OF SILOS FOR CONGLUTATING COARSE-GRAINED BULK SOLIDS
    BECKHAUS, R
    FELGNER, W
    RUNGE, J
    [J]. CHEMIE INGENIEUR TECHNIK, 1992, 64 (03) : 292 - 293
  • [43] Multiscale simulations of protein landscapes: Using coarse-grained models as reference potentials to full explicit models
    Messer, Benjamin M.
    Roca, Maite
    Chu, Zhen T.
    Vicatos, Spyridon
    Kilshtain, Alexandra Vardi
    Warshel, Arieh
    [J]. PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS, 2010, 78 (05) : 1212 - 1227
  • [44] The multiscale coarse-graining method. II. Numerical implementation for coarse-grained molecular models
    Noid, W. G.
    Liu, Pu
    Wang, Yanting
    Chu, Jhih-Wei
    Ayton, Gary S.
    Izvekov, Sergei
    Andersen, Hans C.
    Voth, Gregory A.
    [J]. JOURNAL OF CHEMICAL PHYSICS, 2008, 128 (24):
  • [45] Dynamical coarse-grained models of molecular liquids and their ideal and non-ideal mixtures
    Tripathy, Madhusmita
    Klippenstein, Viktor
    Van der Vegt, Nico F. A.
    [J]. JOURNAL OF CHEMICAL PHYSICS, 2023, 159 (09):
  • [46] Representability and Dynamical Consistency in Coarse-Grained Models
    Banos, Manuel Palma
    Popov, Alexander V.
    Hernandez, Rigoberto
    [J]. JOURNAL OF PHYSICAL CHEMISTRY B, 2024, 128 (06): : 1506 - 1514
  • [47] Developing coarse-grained models for agglomerate growth
    Milena Smiljanic
    Rudolf Weeber
    Dirk Pflüger
    Christian Holm
    Andreas Kronenburg
    [J]. The European Physical Journal Special Topics, 2019, 227 : 1515 - 1527
  • [48] Sequence design in coarse-grained protein models
    Irbäck, A
    [J]. PROGRESS OF THEORETICAL PHYSICS SUPPLEMENT, 2000, (138): : 273 - 281
  • [49] Concurrent multiscale simulation and coarse-grained molecular dynamics.
    Rudd, RE
    [J]. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2001, 221 : U432 - U432
  • [50] Systematic derivation of hybrid coarse-grained models
    Di Pasquale, Nicodemo
    Hudson, Thomas
    Icardi, Matteo
    [J]. PHYSICAL REVIEW E, 2019, 99 (01)