The Faculty of Mathematics and Natural Sciences: Search
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In Silico Facets of Biochemical Research: Accounts from Protein Folding and Protein-Ligand Interaction Studies
(2020-09-04)
Exponential advancements in computer technology over the last five decades have ubiquitously benefited science and humanity as a whole. Consequent beneficiaries of this surge of computational power include all subfields ......
Novel Methods for Molecular and Ionic Liquids: From Fundamentals to Applications as Electrolytes
(2021-09-13)
The trend towards sustainable technologies and processes requires the development of suitable solvents and electrolytes. In this regard, next to traditional molecular solvents, ionic liquids (ILs) are regarded as promising ...
In Silico Understanding of the Hydrogen Bond Network in Organic Solvent Mixtures
(2022-05-20)
In the framework of green chemistry, it is fundamental to further investigate the intermolecular interactions that define the dynamics and structure of liquids and their mixtures. Among those, the hydrogen bond in particular ...