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List of works by Kevin Maik Jablonka

14 examples of how LLMs can transform materials science and chemistry: a reflection on a large language model hackathon

scientific article published in January 2023

A data-driven perspective on the colours of metal–organic frameworks

scientific article published on 28 December 2020

An Ecosystem for Digital Reticular Chemistry

scientific article published in 2023

Applicability of Tail Corrections in the Molecular Simulations of Porous Materials

scientific article published on 06 September 2019

Bias free multiobjective active learning for materials design and discovery

scientific article

Big-Data Science in Porous Materials: Materials Genomics and Machine Learning

scientific article published on 10 June 2020

Characterization of Chemisorbed Species and Active Adsorption Sites in Mg–Al Mixed Metal Oxides for High-Temperature CO 2 Capture

scientific article published on 21 April 2022

Data-Driven Matching of Experimental Crystal Structures and Gas Adsorption Isotherms of Metal–Organic Frameworks

scientific article published on 17 February 2022

Diversifying Databases of Metal Organic Frameworks for High-Throughput Computational Screening

scientific article published on 15 December 2021

Machine learning for industrial processes: Forecasting amine emissions from a carbon capture plant

scientific article published in 2023

Making Molecules Vibrate: Interactive Web Environment for the Teaching of Infrared Spectroscopy

scientific article published on 25 January 2022

Making the collective knowledge of chemistry open and machine actionable

scientific article published on 4 April 2022

The Role of Machine Learning in the Understanding and Design of Materials

scientific article published on 10 November 2020

Understanding the diversity of the metal-organic framework ecosystem

scientific article published on 13 August 2020

Using collective knowledge to assign oxidation states of metal cations in metal–organic frameworks

scientific article published on 5 July 2021

xtal2png: A Python package for representing crystal structure as PNG files

scientific article published on 3 August 2022

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