caa a22 4500 44539112X CHVBK 20180317143047.0 cr unu---uuuuu 170323e20110801xx s 000 0 eng 10.1007/s10955-011-0266-z doi (NATIONALLICENCE)springer-10.1007/s10955-011-0266-z Unraveling the Beautiful Complexity of Simple Lattice Model Polymers and Proteins Using Wang-Landau Sampling [Elektronische Daten] [T. Wüst, Y. Li, D. Landau] We describe a class of "bare bones” models of homopolymers which undergo coil-globule collapse and proteins which fold into their native states in free space or into denatured states when captured by an attractive substrate as the temperature is lowered. We then show how, with the use of a properly chosen trial move set, Wang-Landau Monte Carlo sampling can be used to study the rough free energy landscape and ground (native) states of these intriguingly simple systems and thus elucidate their thermodynamic complexity. Springer Science+Business Media, LLC, 2011 Lattice homopolymers nationallicence Lattice proteins nationallicence Wang-Landau sampling nationallicence Protein adsorption nationallicence Wüst T. Center for Simulational Physics, The University of Georgia, 30602, Athens, GA, USA aut Li Y. Center for Simulational Physics, The University of Georgia, 30602, Athens, GA, USA aut Landau D. Center for Simulational Physics, The University of Georgia, 30602, Athens, GA, USA aut Journal of Statistical Physics Springer US; http://www.springer-ny.com 144/3(2011-08-01), 638-651 0022-4715 144:3<638 2011 144 10955 https://doi.org/10.1007/s10955-011-0266-z text/html Onlinezugriff via DOI 1 research-article jats NATIONALLICENCE 856 40 https://doi.org/10.1007/s10955-011-0266-z text/html Onlinezugriff via DOI NATIONALLICENCE 700 1- Wüst T. Center for Simulational Physics, The University of Georgia, 30602, Athens, GA, USA aut NATIONALLICENCE 700 1- Li Y. Center for Simulational Physics, The University of Georgia, 30602, Athens, GA, USA aut NATIONALLICENCE 700 1- Landau D. Center for Simulational Physics, The University of Georgia, 30602, Athens, GA, USA aut NATIONALLICENCE 773 0- Journal of Statistical Physics Springer US; http://www.springer-ny.com 144/3(2011-08-01), 638-651 0022-4715 144:3<638 2011 144 10955 Metadata rights reserved Springer special CC-BY-NC licence nationallicence BK010053 XK010053 XK010000 NATIONALLICENCE NATIONALLICENCE NL-springer