Entropy sampling Monte Carlo for polypeptides and proteins

被引：17
|
作者：
Scheraga, HA [1 ]
Hao, MH [1 ]
机构：
[1] Cornell Univ, Baker Lab Chem, Ithaca, NY 14853 USA
来源：
MONTE CARLO METHODS IN CHEMICAL PHYSICS | 1999年 / 105卷
关键词：
D O I：
10.1002/9780470141649.ch8
中图分类号：
O64 [物理化学（理论化学）、化学物理学]; O56 [分子物理学、原子物理学];
学科分类号：
070203 ; 070304 ; 081704 ; 1406 ;
摘要：
引用
收藏
页码：243 / 272
页数：30
相关论文
共 50 条
  • [1] Monte Carlo, maximum entropy and importance sampling
    Levine, RD
    CHEMICAL PHYSICS, 1998, 228 (1-3) : 255 - 264
  • [2] Method of Monte Carlo entropy sampling in polymer systems
    Sikorski, A
    POLIMERY, 2000, 45 (7-8) : 514 - 519
  • [3] Shrinking residues for enhanced Monte Carlo sampling for proteins
    Nichols, Sara E.
    Tirado-Rives, Julian
    Jorgensen, William L.
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2006, 232 : 317 - 317
  • [4] Monte Carlo Potential Energy Sampling for Molecular Entropy in Zeolites
    Jorgensen, Mikkel
    Chen, Lin
    Gronbeck, Henrik
    JOURNAL OF PHYSICAL CHEMISTRY C, 2018, 122 (35): : 20351 - 20357
  • [5] Adaptive sampling with Renyi entropy in Monte Carlo path tracing
    Xu, Q
    Hu, RJ
    Xing, LP
    Xu, Y
    2005 IEEE International Symposium on Signal Processing and Information Technology (ISSPIT), Vols 1 and 2, 2005, : 784 - 788
  • [6] Sampling of the conformational landscape of small proteins with Monte Carlo methods
    Heilmann, Nana
    Wolf, Moritz
    Kozlowska, Mariana
    Sedghamiz, Elaheh
    Setzler, Julia
    Brieg, Martin
    Wenzel, Wolfgang
    SCIENTIFIC REPORTS, 2020, 10 (01)
  • [7] Adaptive sampling for Monte Carlo global illumination using Tsallis entropy
    Xu, Q
    Bao, SQ
    Zhang, R
    Hu, RJ
    Sbert, M
    COMPUTATIONAL INTELLIGENCE AND SECURITY, PT 2, PROCEEDINGS, 2005, 3802 : 989 - 994
  • [8] Sampling of the conformational landscape of small proteins with Monte Carlo methods
    Nana Heilmann
    Moritz Wolf
    Mariana Kozlowska
    Elaheh Sedghamiz
    Julia Setzler
    Martin Brieg
    Wolfgang Wenzel
    Scientific Reports, 10
  • [9] COMP 276-Multiscale Monte Carlo sampling of proteins
    Nilmeier, Jerome P.
    Coutsias, Evangelos A.
    Jacobson, Matthew P.
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2008, 235
  • [10] Monte Carlo sampling algorithm for searching a scale-transformed energy space of polypeptides
    Nakamura, H
    JOURNAL OF COMPUTATIONAL CHEMISTRY, 2002, 23 (04) : 511 - 516
12345