Calculations on the effect of sulfur-substitution on guanine on a DNA oligomer - oligomer containing thioguanine.
datasetposted on 11.08.2017 by Elaine Moore, YAO XU
Datasets usually provide raw data for analysis. This raw data often comes in spreadsheet form, but can be any collection of data, on which analysis can be performed.
Results of calculations using molecular dynamics over 15 ns (AMBER) on a DNA oligomer containing thioguanine in explicit water (TIP3P).
Output of analysis of these results using AMBER tools and X3DNA to obtain variation of oligomer properties with time.