Molecular simulation of a group of amino acids revealing their dynamic behaviour on nanoseconds time-scale
Even the building blocks of life are constantly on the move. Here, brightly coloured amino acids jitter around due to tiny, but powerful, molecular forces. Their chemical structures bond together to make proteins, each connected to the whole by a looping ‘backbone’ (pink). These molecular simulations, based on a variety of data fed into a computer model, allow researchers to watch the molecular 'dance' that might otherwise be hidden inside living cells. Zooming in, they might study how proteins fold into 3D shapes to act as tiny machines in life’s processes. Simulations can also make predictions for how changes to the amino acid sequence – caused by genetic mutations – might affect how proteins behave in health and disease. Similar models, albeit with different demands on computer power, might follow multiple proteins as they whirl, vibrate and clash through daily life.
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