Journal of Materials Chemistry C · 2024 · 19 citations · 63 references
EngineeringPhysicsNatural SciencesEnd Group ModificationMolecular Stacking CharacteristicsApplied PhysicsMolecular BiologyTheoretical Computational SimulationMultiscale Computational AnalysisEnd Group ModificationsComputational ChemistryQuantum ChemistryChemistryMolecular Chemistry
Theoretical computational simulation are used to analyse the molecular stacking characteristics of PM6:BTP- x OSCs and the role of end group modifications.
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VMD: Visual molecular dynamics
William Humphrey, Andrew Dalke, Klaus Schulten · Journal of Molecular Graphics · 1996 · 64.1K citations
Engineering, Visual Molecular Dynamics, Molecular Biology +5