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This article analyzes the superoxide dismutase-like catalytic mechanism of carbon dot nanozymes and reveals the role of surface-abundant oxygen-containing functional groups, such as carbonyl, carboxyl, and hydroxyl, as substrate binding or catalytic sites

doi: 10.1038/s41580-020-00324-8 39 LewerenzJHewettSJHuangYLambrosMGoutPWKalivasPWet al

The initial coordinates for the simulation input files and the coordinate files for the final output of PDL1_WT, PV2_WT, PV2_C23pAcF, PV2_C96pAcF, and PV3_WT are provided as supplementary files

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