MIT Open Access Articles: Recent submissions
Now showing items 103-105 of 55794
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Role of Active Site Residues and Weak Noncovalent Interactions in Substrate Positioning in N,N-Dimethylformamidase
(American Chemical Society, 2025-06-17)N,N-Dimethylformamide (DMF) is a solvent that can be metabolized naturally by DMF-utilizing microorganisms via a nonheme iron enzyme N,N-dimethylformamidase (DMFase). DMF is a small molecule with very few hydrogen bond ... -
Benchmarking nitrous oxide adsorption and activation in metal–organic frameworks bearing coordinatively unsaturated metal centers
(Royal Society of Chemistry, 2024)Anthropogenic emissions of N2O, the third most abundant greenhouse gas after CO2 and CH4, are contributing to global climate change. Although metal–organic frameworks (MOFs) have been widely studied as adsorbents for CO2 ... -
MOFs with the Stability for Practical Gas Adsorption Applications Require New Design Rules
(American Chemical Society, 2024-10-04)Metal-organic frameworks (MOFs) have been widely studied for their ability to capture and store greenhouse gases. However, most computational discovery efforts study hypothetical MOFs without consideration of their stability, ...
