Development and initial testing of an empirical forcefield for simulation of poly(alkylthiophenes)

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Development and initial testing of an empirical forcefield for simulation of poly(alkylthiophenes) is …
instance of (P31):
scholarly articleQ13442814

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P356DOI10.1016/J.JMGM.2008.02.005
P932PMC publication ID2873194
P698PubMed publication ID18485769
P5875ResearchGate publication ID5364315

P50authorYoky MatsuokaQ16221584
Alik S WidgeQ48181536
P2093author name stringMaria Kurnikova
P2860cites workDevelopment and testing of a general amber force fieldQ29547642
Exploring protein native states and large-scale conformational changes with a modified generalized born modelQ29617088
Computational modeling of poly(alkylthiophene) conductive polymer insertion into phospholipid bilayersQ33858217
Triple helical structure and stabilization of collagen-like molecules with 4(R)-hydroxyproline in the Xaa positionQ34353006
Chemical and biological sensors based on organic thin-film transistors.Q36218271
Parallel tempering: theory, applications, and new perspectivesQ37610077
New-generation amber united-atom force fieldQ46342317
Use of the Weighted Histogram Analysis Method for the Analysis of Simulated and Parallel Tempering SimulationsQ46477254
Self-assembled monolayers of polythiophene conductive polymers improve biocompatibility and electrical impedance of neural electrodesQ51125151
Optimal allocation of replicas in parallel tempering simulationsQ51557130
Conformational disorder of conjugated polymersQ79292729
Selection of temperature intervals for parallel-tempering simulationsQ81830271
Conformational structure, dynamics, and solvation energies of small alanine peptides in water and carbon tetrachlorideQ83178482
P433issue1
P407language of work or nameEnglishQ1860
P304page(s)34-44
P577publication date2008-03-06
P1433published inJournal of Molecular Graphics & ModellingQ3186928
P1476titleDevelopment and initial testing of an empirical forcefield for simulation of poly(alkylthiophenes)
P478volume27

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cites work (P2860)
Q57428726Correlating fullerene diffusion with the polythiophene morphology: molecular dynamics simulations
Q87169016Improved Force Field for Molecular Modeling of Poly(3-hexylthiophene)

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