Exploration of the folding dynamics of human telomeric G-quadruplex with a hybrid atomistic structure-based model

• Published in: The Journal of chemical physics Vol. 148; no. 20; pp. 204107 - 204114
• Main Authors: Bian, Yunqiang, Ren, Weitong, Song, Feng, Yu, Jiafeng, Wang, Jihua
• Format: Journal Article
• Language: English
• Published: United States American Institute of Physics 28.05.2018
• Subjects: Computer simulation; Deoxyribonucleic acid; DNA; Folding; Markov chains; Molecular dynamics; Proteins; Simulation

Structure-based models or Gō-like models, which are built from one or multiple particular experimental structures, have been successfully applied to the folding of proteins and RNAs. Recently, a variant termed the hybrid atomistic model advances the description of backbone and side chain interaction...