Planar Chirality for Acid/Base Responsive Macrocyclic Pillararenes Induced by Amino Acid Derivatives: Molecular Dynamics Simulations and Machine Learning.
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DOI: 10.1021/acs.jctc.2c01265
Abstract: Chirality is ubiquitous in nature, ranging from a DNA helix to a biological macromolecule, snail's shell, and even a galaxy. However, the precise control of chirality at the nanoscale is a challenge due to the… read more here.
Keywords: planar chirality; molecular dynamics; acid base; wp5 ... See more keywords