DNMT3A/B MD Trajectories
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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. All the MD related parameter files and trajectory analysis scripts are deposited at https://github.com/CSB-KaracaLab/DNMT3AB_specificity/ Our work is described in detail at https://www.biorxiv.org/content/10.1101/2024.02.07.579311v3
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Zenodo创建时间：
2024-06-26
