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Monte Carlo simulation and molecular theory of tethered polyelectrolytes

✍ Scribed by Hehmeyer, Owen J.; Arya, Gaurav; Panagiotopoulos, Athanassios Z.; Szleifer, Igal


Book ID
120222557
Publisher
American Institute of Physics
Year
2007
Tongue
English
Weight
510 KB
Volume
126
Category
Article
ISSN
0021-9606

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## Abstract A formal partially dynamical approach to ergodic sampling, hybrid Monte Carlo, has been adapted for the first time from its proven application in quantum chromodynamics to realistic molecular systems. A series of simulations of pancreatic trypsin inhibitor were run using temperature‐res