WebDec 26, 2013 · We believe that this work represents the first instance where the Fixman potential has been used for general branched systems, and establishes the viability for its use in constrained dynamics simulations of proteins and other macromolecules. ACKNOWLEDGMENTS This work was supported by funding from NIH Grant No. … http://www.nasonline.org/publications/biographical-memoirs/memoir-pdfs/fixman-marshall.pdf
The conformational origin of flexibility and stiffness in poly(olefin ...
WebI. General theory The Journal of Chemical Physics. 69: 1527-1537: Fixman M, Evans GT. (1978) Dynamics of stiff polymer chains. V. Interaction between local and global modes The Journal of Chemical Physics. 68: 195-208: Evans GT, Fixman M. (1976) The effect of shape anisotropy on the neutron scattering from diatomiclike molecules The Journal of ... WebAug 11, 2008 · ABSTRACT. Methods are presented for the simulation of conformational relaxation processes in polymer chains. The chains interact with the solvent through frictional and Langevin forces, have constrained bond lengths and angles, and smooth rotational energy functions. Relationships are obtained between the stochastic difference … fish restaurant philadelphia
Rotational diffusion tensors for non-spherical molecules
WebJan 2, 2008 · Rheology and microstructure of plate-like particle suspensions in linear shear flows are studied through Stokesian dynamics simulations with Brownian motion for a range of volume fraction ϕ up to 0.30 and Peclet number Pe ranging from 0.01 to 10 4.As in Part I [Meng and Higdon, J. Rheol. 52, 1 (2008)], particles are modeled as planar … WebChemical structure is related to properties on the basis of results of computer modelling of mechanical behavior. An equation for the shift factor a T,c dependent on temperature T … WebDec 1, 2015 · Fixman M. Simulation of polymer dynamics. I. General theory. J Chem Phys. 1978; 69 (4):1527–1537. [Google Scholar] 29. Grassia PS, Hinch EJ, Nitsche LC. Computer simulations of Brownian motion of complex systems. J Fluid Mech. 1995; 282:373–403. [Google Scholar] 30. Beenakker CWJ. Ewald sums of the Rotne-Prager … candle jars with wood lids wholesale