Ab Initio Screening Approach for the Discovery of Lignin Polymer Breaking Pathways
The directed depolymerization of lignin biopolymers is of utmost relevance for the valorization or commercialization of biomass fuels. We present a computational and theoretical screening approach to identify potential cleavage pathways and resulting fragments that are formed during depolymerization...
Main Authors: | Liu, Fang, Mar, Brendan D., Qi, Helena Wen, Kulik, Heather Janine |
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Other Authors: | Massachusetts Institute of Technology. Department of Chemical Engineering |
Format: | Article |
Language: | en_US |
Published: |
American Chemical Society (ACS)
2016
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Online Access: | http://hdl.handle.net/1721.1/105336 https://orcid.org/0000-0002-2128-1791 https://orcid.org/0000-0001-9342-0191 |
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