Guidelines for designing peptoid structures: Insights from the Peptoid Data Bank

JRB Eastwood, EI Weisberg, D Katz… - Peptide …, 2023 - Wiley Online Library
The number of structural studies of peptoids has grown dramatically over the past 20 years.
To date, over 100 high‐resolution structures have been reported for peptoids, which are …

Cooperative Intramolecular Hydrogen Bonding Strongly Enforces cis-Peptoid Folding

AW Wijaya, AI Nguyen, LT Roe… - Journal of the …, 2019 - ACS Publications
Sequence-defined peptoids, or N-substituted glycines, are an attractive class of bioispired
polymer due to their biostability and efficient synthesis. However, the de novo design of …

Development of a Systematic and Extensible Force Field for Peptoids (STEPs)

BS Harris, KK Bejagam, MD Baer - The Journal of Physical …, 2023 - ACS Publications
Peptoids (N-substituted glycines) are a class of biomimetic polymers that have attracted
significant attention due to their accessible synthesis and enzymatic and thermal stability …

Metal cation-binding mechanisms of q-proline peptoid macrocycles in solution

MFD Hurley, JD Northrup, Y Ge… - Journal of chemical …, 2021 - ACS Publications
The rational design of foldable and functionalizable peptidomimetic scaffolds requires the
concerted application of both computational and experimental methods. Recently, a new …

Conformational control via sequence for a heteropeptoid in water: coupled NMR and Rosetta modelling

T Rajale, JC Miner, R Michalczyk, ML Phipps… - Chemical …, 2021 - pubs.rsc.org
We report a critical advance in the generation and characterization of peptoid hetero-
oligomers. A library of sub-monomers with amine and carboxylate side-chains are combined …

[图书][B] Advancing Simulation Methods for Molecular Design and Drug Discovery

MFD Hurley - 2022 - search.proquest.com
Investigating interactions between proteins and small molecules at an atomic scale is
fundamental towards understanding biological processes and designing novel candidates …

Design of Peptoid Foldamers: Building Beyond the Boundaries of Biology

JRB Eastwood - 2023 - search.proquest.com
Foldamers are an emerging class of macromolecules, inspired by biopolymers, that fold into
well-defined conformations that determine their properties and function. Oligomers of N …