Open Access

Pressure-induced pKa shifts influence conformations of pH-sensitive polymers

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data.tar.xz (This dataset contains input scripts and files to generate the data for the publication titled "Pressure-induced pKa shifts influence conformations of pH-sensitive polymers".) (85.25 MB)

Date

2025-09-03

Type

Dataset
Software

Authors

Mahajan, Ved
Mandalaparthy, Varun
van der Vegt, Nico

Journal Title

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Abstract

Description

This dataset contains input scripts and files to generate the data for the publication titled "Pressure-induced pKa shifts influence conformations of pH-sensitive polymers".

Keywords

Pressure, pH-sensitive polymer, constant pH MD

Citation

Identifier

https://tudatalib.ulb.tu-darmstadt.de/handle/tudatalib/4787
 https://doi.org/10.48328/tudatalib-1927

Endorsement

DFG Classification

3.13-01 Physikalische Chemie von Molekülen, Flüssigkeiten und Grenzflächen, Biophysikalische Chemie

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CC BY 4.0 - Attribution 4.0 International
Except where otherwise noted, this license is described as CC BY 4.0 - Attribution 4.0 International