629 results on '"Mattice, Wayne L."'
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2. Rotational Isomeric State Methods
3. Simulations of Thin Films and Fibers of Amorphous Polymers
4. Bridging the Gap Between Atomistic and Coarse-Grained Models of Polymers: Status and Perspectives
5. Monte Carlo Simulation of Self-Assembly in Macro-Molecular Systems
6. The β Sheet ⇌ Coil Transition of Polypeptides, as Determined by Circular Dichroism
7. Conformational Analysis of Profisetinidin Dimers
8. Fluorescence of Oligomers that Contain Catechin or Epicatechin
9. Atomistic simulation of orientation of methyl groups and methylene bisectors, and surface segregation, in freely standing thin films of atactic poly(ethylene-co-propylene)
10. Dimensions of matrix chains in polymers filled with energetically neutral nanoparticles
11. Energetic and entropic contributions to the surface energy of a free-standing thin film of n-tetracontane
12. Orientation of phenyl rings and methylene bisectors at the free surface of atactic polystyrene
13. Segregation of chain ends is a weak contributor to increased mobility at free polymer surfaces
14. Atomistic simulations of the surfaces of thin films of random copolymers
15. Conformational origin of the molecular weight dependence of the characteristic ratio of the dipole moment in poly(A-B)
16. Average density of chain atoms at points along the contour of freely jointed chains
17. Collapsed chains as models for filler particles in a polymer melt
18. Conformational end effects in unperturbed chains and star-branched polymers
19. Intramolecular energy transfer in naphthalene-containing polyesters: Experiment and simulation for model compounds derived from five aliphatic dicarboxylic acids and 2-hydroxynaphthalene
20. Interaction of catechin with poly(L-proline)
21. Intramolecular energy transfer in compounds with two 1-pyrenoate groups separated by methylene spacers
22. Inclusion complexes of 2-methylnaphthoate and gamma-cyclodextrin: experimental thermodynamics and molecular mechanics calculations
23. Structure and energy of thin films of poly-(1,4-cis-butadiene): A new atomistic approach
24. Photophysical models of aromatic polyesters: excited state interactions in bis(phenalkyl)terephthalate
25. Implications of the fluorescence for the conformational analysis of polymeric profisetinidins and procyanidins
26. A Monte Carlo simulation of coarse-grained poly(silylenemethylene) and poly(dimethylsilylenemethylene) melts
27. Substituted poly(silylenemethylene)s with short range interactions that induce a preference for the same local conformation in unperturbed atactic, isotactic, and syndiotactic chains
28. Detection of the rate of exchange of chains between micelles formed by diblock copolymers in aqueous solution
29. Intramolecular vs intermolecular formation of bityrosine upon photoreaction of poly(l-tyrosine) in dilute aqueous solution
30. On the location of the free ends of the insoluble block in micelles formed by diblock copolymers
31. Micelles and networks formed by symmetric triblock copolymers in dilute solutions that are poor solvents for the terminal blocks
32. A harmonic oscillator model of the conformationally flexible helical polymeric molecules
33. Pairwise Interactions in the Critical Micelle Concentrations of Diblock Copolymers
34. Simulation of the initial development of an inhomogeneous structure upon cooling an elastomeric polypropylene from a homogeneous melt
35. Comparison of the diffusion coefficients of linear and cyclic alkanes
36. Study on structure formation of short polyethylene chains via dynamic Monte Carlo simulation
37. Interior segment regrowth configurational-bias algorithm for the efficient sampling and fast relaxation of coarse-grained polyethylene and polyoxyethylene melts on a high coordination lattice.
38. Calculation of pressure using the virtual-volume-variation method and the virial method from chain conformations obtained by Monte Carlo simulations on the second nearest neighbor diamond lattice.
39. Molecular origin of demixing, prior to crystallization, of atactic polypropylene/isotactic polypropylene blends upon cooling from the melt.
40. Modification of statistical threading in two-component pseudorotaxane melts using the amphiphilic approach and variations in the confinement geometry.
41. Configuration selection in the simulations of the crystallization of short polyethylene chains in a free-standing thin film.
42. Monte Carlo simulation on the glass transition of free-standing atactic polypropylene thin films on a high coordination lattice.
43. Monte Carlo simulation on separation and co-crystallization of a mixture of short polyethylene chains in a thin film.
44. Radial aspect of local dynamics in polybutadiene melts as studied by molecular dynamics simulation: To hop or not to hop.
45. Monte Carlo simulation of the crystallization and annealing of a freestanding thin film of n-tetracontane.
46. Role of the attractive portion of the Lennard-Jones potential in the homogeneity of melts of isotactic and syndiotactic polypropylene.
47. Interaction of Condensed Tannins with Biopolymers
48. Conformational Analysis of Oligomeric Proanthocyanidins
49. Detection of the onset of demixing in simulations of polypropylene melts in which the chains...
50. Local chain dynamics of bulk amorphous polybutadienes: A molecular dynamics study.
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