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Pressemitteilungen

ChemRxiv: Preprint-Publikationen

Yuji Mochizuki · Ryohei Yoshine et al.

Automatic detection of interacting carbonyl oxygens in peptide bond for the fragment molecular orbital method

Malte von Arnim

Comparison of internal Coordinate Frameworks for molecular Dynamics Simulations

Niklas Geue · Kim Greis et al.

Evaluating C2-Neighbouring and C3-, C4-, C6-Remote Participation in Peracetylated Glycosyl Cations

Meema Bhati · Kavita Joshi

Understanding Comparative Adsorption of CO2 and Trace Impurities on ZnO Facets: A DFT Perspective

Yuji Mochizuki · Ryohei Yoshine et al.

Automatic detection of interacting carbonyl oxygens in peptide bond for the fragment molecular orbital method

Malte von Arnim

Comparison of internal Coordinate Frameworks for molecular Dynamics Simulations

Niklas Geue · Kim Greis et al.

Evaluating C2-Neighbouring and C3-, C4-, C6-Remote Participation in Peracetylated Glycosyl Cations

Meema Bhati · Kavita Joshi

Understanding Comparative Adsorption of CO2 and Trace Impurities on ZnO Facets: A DFT Perspective

Jonghee Yang · Hochan Song et al.

High-Throughput Automated Discovery of Temperature-Benign Dion-Jacobson Quasi-2D Halide Perovskites

Kolattukudy P. Santo · Younjin Min et al.

Interactions of Amphiphilic Janus Nanoparticles with Lipid Monolayers

Matthias Hartlieb · Anne-Catherine Lehnen et al.

The interplay of multivalence and amphiphilicity in antimicrobial bottle brush copolymers

Davide Accomasso · Mario Taddei et al.

Revealing the First Steps of the Internal Conversion Mechanism in UV-excited Ir(2-ppy)3: Full-Dimensional Nonadiabatic Quantum Dynamics Simulations of the Ligand

Ashish Kumar Shukla · Kshatresh Dutta Dubey et al.

Single-Particle Electrochemistry for Active Matter: Advancing the Detection and Analysis of Artificial Micromotors, Bacteria and Enzymes

Lei Sun · Yingchao Wang et al.

Screening-Enabled Chemiresistive Moisture Sensing with Tetrathiafulvalene-Based Electrically Conductive Metal−Organic Frameworks