Theoretical study of the interaction of IRMOF-1 (MOF-5) with Valine, Alanine, and Norleucine amino acids
We have investigated by density functional theory the interaction of representative amino acids such as valine (Val), alanine (Ala) and norleucine (Nle) with a suitably functionalized organic linker of the IRMOF-1 (MOF-5) metal-organic framework. The binding energy value of -8.19 kcal/mol, -9.32 kc...
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Global Scientific Journal
2022
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