Grand canonical Monte Carlo polymers

R. L. C. Vink and J. Horbach (2004) Grand canonical Monte Carlo simulation of a model colloid-polymer mixture Coexistence line, critical behavior, and interfacial tension. J. Chem. Phys. 121, pp. 3253-3258... 

In closing, we would like to mention some applications of the GEMC/CBMC approach and very much related combination of CBMC and the grand canonical Monte Carlo technique to other complex systems prediction of structure and transfer free energies into dry and water-saturated 1-octanol [72], prediction of the solubility of polymers in supercritical carbon dioxide [73], prediction of the upper critical solution pressure for gas-expanded liquids [74], investigation of the formation of multiple hydrates for a pharmaceutical compound [75], exploration of multicomponent vapor-to-particle nucleation pathways [76], and investigations of the adsorption of articulated molecules in zeolites and metal organic frameworks [77, 78]. 

Escobedo F A and de Pablo J J 1996 Expanded grand canonical and Gibbs ensemble Monte Carlo simulation of polymers J. Chem. Phys. 705 4391-4... 

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