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Physical Chemistry

Working Paper

Screening of Hydrogen Bonding Interactions by a Single Layer Graphene

Babu Gaire, Saranshu Singla, Ali Dhinojwala

Version 1 posted 16 February 2021

268

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Physical Chemistry

Working Paper

Grand-reaction method for simulations of ionization equilibria coupled to ion partitioning

Jonas Landsgesell, Oleg Rud, Pascal Hebbeker, Raju Lunkad, Peter Košovan, Christian Holm

Version 4 posted 19 March 2020

1,591

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Inorganic Chemistry

Working Paper

Functionalization of mono- and bimetallic MIL-100(Al,Fe) MOFs by ethylenediamine: post-functionalization, Brønsted acido-basicity and unique CO2 sorption behaviour

Timothy Steenhaut, Luca Fusaro, Koen Robeyns, Séraphin Lacour, Xiao Li, Julien G. Mahy, Véronique Louppe, Nicolas Grégoire, Gabriella Barozzino-Consiglio, Jean-François Statsijns, Carmela Aprile, Yaroslav Filinchuk, Sophie Hermans

Version 1 posted 19 July 2021

547

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Physical Chemistry

Working Paper

Charge regulation triggers condensation of short oligopeptides to polyelectrolytes

Sebastian Pineda, Roman Staňo, Anastasiia Murmiliuk, Pablo Blanco, Patricia Montes, Zdeněk Tošner, Ondřej Groborz, Jiří Pánek, Martin Hrubý, Miroslav Štepánek, Peter Kosovan

Version 2 posted 17 January 2024

409

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Nanoscience

Working Paper

Tuning Brønsted Acidity by up to 12 pKa Units in a Redox-Active Nanopore Lined with Multifunctional Metal Sites

Taro J. Jones, Kaitlyn G. Dutton, Harender S. Dhattarwal, P. Thomas Blackburn, Richard C. Remsing, Mark C. Lipke

Version 2 posted 26 June 2024

235

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Polymer Science

Working Paper

Anionically-functionalized glycogen encapsulates melittin by multivalent interactions

Hanna Zhukouskaya, Pablo Blanco, Zulfiya Černochová, Lucie Čtveráčková, Roman Staňo, Ewa Pavlova, Miroslav Vetrík, Peter Černoch, Marcela Filipová, Miroslav Štěpánek, Martin Hurbý, Peter Košovan, Jiří Pánek

Version 1 posted 22 March 2022

314

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Physical Chemistry

Working Paper

Quantitative Prediction of Charge Regulation in Oligopeptides

Raju Lunkad, Anastasiia Murmiliuk, Pascal Hebbeker, Milan Boublík, Zdeněk Tošner, Miroslav Štěpánek, Peter Košovan

Version 4 posted 16 November 2020

1,269

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Physical Chemistry

Working Paper

The pH-dependent Swelling of Weak Polyelectrolyte Hydrogels Modeled at Different Levels of Resolution

Jonas Landsgesell, David Beyer, Pascal Hebbeker, Peter Košovan, Christian Holm

Version 2 posted 08 February 2022

673

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8 results in Acid-base in Keywords: Acid-base

Screening of Hydrogen Bonding Interactions by a Single Layer Graphene

Grand-reaction method for simulations of ionization equilibria coupled to ion partitioning

Functionalization of mono- and bimetallic MIL-100(Al,Fe) MOFs by ethylenediamine: post-functionalization, Brønsted acido-basicity and unique CO2 sorption behaviour

Charge regulation triggers condensation of short oligopeptides to polyelectrolytes

Tuning Brønsted Acidity by up to 12 pKa Units in a Redox-Active Nanopore Lined with Multifunctional Metal Sites

Anionically-functionalized glycogen encapsulates melittin by multivalent interactions

Quantitative Prediction of Charge Regulation in Oligopeptides

The pH-dependent Swelling of Weak Polyelectrolyte Hydrogels Modeled at Different Levels of Resolution

8 results in Keywords: Acid-base