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Updated: Jul 20, 2025

Biosensor-based High Throughput Biopanning and Bioinformatics Analysis Strategy for the Global Validation of Drug-protein Interactions
Published on: December 1, 2020
Unbiased in silico design of pH-sensitive tetrapeptides
Yue Hu1, Federica Rigoldi1, Hui Sun1
1Civil and Environmental Engineering, Massachusetts Institute of Technology, Cambridge, USA. alfonso.gautieri@polimi.it.
Abstract:
We used coarse-grain molecular dynamics simulations to screen all possible histidine-bearing tetrapeptide sequences, finding novel peptide sequences with pH-tunable assembly properties. These tetrapeptides could be used for various biological applications, such as triggered delivery of bioactive molecules.
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