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Article
Open AccessLigninGraphs: lignin structure determination with multiscale graph modeling
Lignin is an aromatic biopolymer found in ubiquitous sources of woody biomass. Designing and optimizing lignin valorization processes requires a fundamental understanding of lignin structures. Experimental cha...
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Article
Open AccessReal-time dynamics and structures of supported subnanometer catalysts via multiscale simulations
Understanding the performance of subnanometer catalysts and how catalyst treatment and exposure to spectroscopic probe molecules change the structure requires accurate structure determination under working con...