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Mod-CSA: Modularity optimization by conformational space annealing
Mod-CSA Modularity optimization conformational space annealing
2012/2/29
We propose a new modularity optimization method, Mod-CSA, based on stochastic global optimization algorithm, conformational space annealing (CSA). Our method outperforms simulated annealing in terms o...
Conformational Stability of Furfural in Aqueous Solution: The Role of Hydrogen Bonding
Furfural Aqueous Solution Hydrogen Bonding
2010/10/18
The importance of hydration on the equilibrium involving internal rotation around carbon-carbon single bond is investigated for the furfural molecule dissolved in water. To analyze the solvent effects...