Europe PMC

Nature of the Fe-O2 bonding in oxy-myoglobin: effect of the protein.

The nature of the Fe-O2 bonding in oxy-myoglobin was probed by theoretical calculations: (a) QM/MM (hybrid quantum mechanical/molecular mechanical) calculations using DFT/MM and CASSCF/MM methods and ...
IEEE

Understanding and Optimizing Oxygen Plasma Treatment for Enhanced Cu-Cu Bonding Application

Abstract: This study investigates the optimization of O2 plasma treatment conditions to enhance Cu-Cu bonding. The O2 plasma treatment conditions were optimized using Design of Experiments (DOE), ...
Europe PMC

Lessons on O2 and NO bonding to heme from ab initio multireference/multiconfiguration and DFT calculations.

This commentary focuses on the conceptual interpretation of the bonding of O(2) and NO to heme in oxyheme and nitrosylheme complexes, using high-level ab initio complete active space self-consistent ...
Nature

Supramolecular Hydrogen-Bonding Networks Amplify Luminol/O2 Chemiluminescence by over 4000-Fold: Mechanistic Insights and Biosensing Application

The Nature Index 2025 Research Leaders — previously known as Annual Tables — reveal the leading institutions and countries/territories in the natural and health sciences, according to their output in ...
C&EN

Hydrogen Bonding and O 2 Affinity of Hemoglobins

Article Views are the COUNTER-compliant sum of full text article downloads since November 2008 (both PDF and HTML) across all institutions and individuals. These metrics are regularly updated to ...
C&EN

O 2 – ·[Polar VOC] Complexes: H-Bonding versus Charge–Dipole Interactions, and the Noninnocence of Formaldehyde

Article Views are the COUNTER-compliant sum of full text article downloads since November 2008 (both PDF and HTML) across all institutions and individuals. These metrics are regularly updated to ...