Analysis of low molecular weight compound-protein interactions using NMR and molecular dynamics calculations.
You can evaluate the interactions between small molecules and proteins using NMR and MD calculations.
Among physiological active compounds, there are many that act by targeting proteins. Therefore, obtaining structural insights into the interactions between small molecules and proteins is very important for drug development. This document presents a case study analyzing the interactions between L-tryptophan and bovine serum albumin (BSA) in solution using NMR and molecular dynamics calculations.
- Company：一般財団法人材料科学技術振興財団 MST
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