Articles with "dissociation pathways" as a keyword



Electronic Structure-Dependent Water-Dissociation Pathways of Ruthenium-Based Catalysts in Alkaline H2 -Evolution.

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Published in 2023 at "Small"

DOI: 10.1002/smll.202206949

Abstract: Ruthenium (Ru)-based catalysts have displayed compelling hydrogen evolution activities, which hold the promising potential to substitute platinum in alkaline H2 -evolution. In the challenging alkaline electrolytes, the water-dissociation process involves multistep reactions, while the profound… read more here.

Keywords: dissociation; based catalysts; water dissociation; dissociation pathways ... See more keywords

Detection of Putative Ligand Dissociation Pathways in Proteins Using Site-Identification by Ligand Competitive Saturation

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Published in 2024 at "Journal of chemical information and modeling"

DOI: 10.1021/acs.jcim.4c01814

Abstract: Drug efficacy often correlates better with dissociation kinetics than binding affinity alone. To study binding kinetics computationally, it is necessary to identify all of the possible ligand dissociation pathways. The site identification by ligand competitive… read more here.

Keywords: dissociation pathways; ligand; dissociation; ligand dissociation ... See more keywords

Decoding Dissociation Pathways of Ligands in Prolyl Oligopeptidase

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Published in 2025 at "Physical Chemistry Chemical Physics"

DOI: 10.1039/d5cp02804c

Abstract: Neurodegenerative diseases, such as Alzheimer's and Parkinson's, pose a growing global health burden. Prolyl oligopeptidase (PREP) has emerged as a potential therapeutic target in these diseases. Recent studies have shown that direct interaction between PREP… read more here.

Keywords: prolyl oligopeptidase; dissociation pathways; decoding dissociation; binding pathways ... See more keywords

On the dissociation pathways of copper complexes relevant as PET imaging agents.

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Published in 2022 at "Journal of inorganic biochemistry"

DOI: 10.2139/ssrn.4067036

Abstract: Several bifunctional chelators have been synthesized in the last years for the development of new 64Cu-based PET agents for in vivo imaging. When designing a metal-based PET probe, it is important to achieve high stability… read more here.

Keywords: dissociation; complexes relevant; relevant pet; dissociation pathways ... See more keywords