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cond-mat.stat-mech2000★ 8 cited
Thermodynamically Important Contacts in Folding of Model Proteins
Antonio Scala, Nikolay V. Dokholyan, Sergey V. Buldyrev +1
We introduce a quantity, the entropic susceptibility, that measures the thermodynamic importance-for the folding transition-of the contacts between amino acids in model proteins. U…
cond-mat.soft2000★ 87 cited
Thermodynamic and structural aspects of the potential energy surface of simulated water
Francis W. Starr, Srikanth Sastry, Emilia La Nave +3
Relations between the thermodynamics and dynamics of supercooled liquids approaching a glass transition have been proposed over many years. The potential energy surface of model li…