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Improving the Acidic Stability of Zeolitic Imidazolate Frameworks by Biofunctional Molecules

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TLDR
It is demonstrated that the acidic stability of two polymorphic ZIFs can be enhanced by the incorporation of functional groups on polypeptides or DNA.
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This article is published in Chem.The article was published on 2019-06-13 and is currently open access. It has received 133 citations till now. The article focuses on the topics: Zeolitic imidazolate framework & Imidazolate.

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Metal-organic frameworks as novel matrices for efficient enzyme immobilization: An update review

TL;DR: Recently, metal-organic frameworks have attracted remarkable research interests as novel supporting matrices for efficient enzyme immobilization and protection as discussed by the authors, which is an efficient strategy for enhancing their catalytic performance in continuous industrial practices.
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Modulating the Biofunctionality of Metal-Organic-Framework-Encapsulated Enzymes through Controllable Embedding Patterns.

TL;DR: These findings show that the enzymes@MOFs, wherein the encapsulation process is driven by the rapid enzymes-triggered nucleation of ZIF-8, can maintain high enzymatic activity comparable to the free enzymes.
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Enzyme embedded metal organic framework (enzyme-MOF): De novo approaches for immobilization.

TL;DR: This review presents a holistic insight of two different de novo strategies i.e. co-precipitation and biomineralization with state-of-art examples of enzyme-MOF biocomposites in terms of catalytic activity, thermal/chemical stability, Michaelis-Menten kinetics, recyclability and storage stability.
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Atypical Hybrid Metal-Organic Frameworks (MOFs): A Combinative Process for MOF-on-MOF Growth, Etching, and Structure Transformation.

TL;DR: The advanced route for the construction of atypical hybrid MOFs with unique morphologies and complicated components through the combination of three distinctive processes is reported, which displayed enhanced oxygen reduction reaction activities compared to their monomeric counterparts.
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Nanobiohybrids: Materials approaches for bioaugmentation

TL;DR: A critical overview of recent developments of nanobiohybrids that enable new or augmented biological functions that show promise in high-tech applications across many disciplines, including energy harvesting, biocatalysis, biosensing, medicine, and robotics are provided.
References
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Journal ArticleDOI

Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set.

TL;DR: An efficient scheme for calculating the Kohn-Sham ground state of metallic systems using pseudopotentials and a plane-wave basis set is presented and the application of Pulay's DIIS method to the iterative diagonalization of large matrices will be discussed.
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Projector augmented-wave method

TL;DR: An approach for electronic structure calculations is described that generalizes both the pseudopotential method and the linear augmented-plane-wave (LAPW) method in a natural way and can be used to treat first-row and transition-metal elements with affordable effort and provides access to the full wave function.
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From ultrasoft pseudopotentials to the projector augmented-wave method

TL;DR: In this paper, the formal relationship between US Vanderbilt-type pseudopotentials and Blochl's projector augmented wave (PAW) method is derived and the Hamilton operator, the forces, and the stress tensor are derived for this modified PAW functional.
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Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set

TL;DR: A detailed description and comparison of algorithms for performing ab-initio quantum-mechanical calculations using pseudopotentials and a plane-wave basis set is presented in this article. But this is not a comparison of our algorithm with the one presented in this paper.
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ATHENA, ARTEMIS, HEPHAESTUS: data analysis for X-ray absorption spectroscopy using IFEFFIT.

TL;DR: A software package for the analysis of X-ray absorption spectroscopy (XAS) data is presented, based on the IFEFFIT library of numerical and XAS algorithms and is written in the Perl programming language using the Perl/Tk graphics toolkit.
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