Posts
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Autocorrelations on Monomers with Specified Radius
In order to improve the quality of the 2-pt Autocorrelation each monomer in the simulation was represented as a sphere with a radius of half the carbon - carbon bond distance -
Summary Of Dr Jacob Meeting
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Detecting Chain Similarity through Pair Correlations in PCA Space
Structurally similar chains were identified by measuring the distances between chains in the PC space. The PC representations of structure were derived from pair autocorrelations. -
Choosing between Structure Representations
A post to accompany an in-class presentation detailing various options for the Representation of the PEMD structure -
Pair Correlations For All Chains
A gallery containing pair correlations for every chain at a single timestep of the aniso11 simulation
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