Hydrogen peroxide decomposes on its own into water and oxygen gas. This process is sped up by a catalyst. In this reaction, the catalyst is potassium permanganate, and the bubbles are full of oxygen ...

The resulting metadynamics trajectories are then analysed with the developed basic graph theoretical algorithms in order to identify the conformations and transitions between them that occur along ...

Code repository for Multilabel Classification Models for the Prediction of Cross-Coupling Reaction Conditions, Michael R. Maser*, Alexander Y. Cui*, Serim Ryou ...