DNMT3A/B MD Trajectories

<p>Ensembles extracted from the MD trajectories of DNMT3A-CGC/T/A/G and DNMT3B-CGG/A/T/C complexes. For each complex, we generated a 500 ns long trajectory and recorded structural snapshots at each 0.5 ns, leading to 1001 conformers per complex.</p> <p>All the MD related parameter files and trajectory analysis scripts are deposited at <a href="https://github.com/CSB-KaracaLab/DNMT3AB_specificity/">https://github.com/CSB-KaracaLab/DNMT3AB_specificity/</a></p> <p>Our work is described in detail at <a href="https://www.biorxiv.org/content/10.1101/2024.02.07.579311v3">https://www.biorxiv.org/content/10.1101/2024.02.07.579311v3</a></p> <p>&nbsp;</p>