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Rajendiran, A
But science has a way of humbling even the most promising ideas
In silico simulations of KA and HQ in the active site TyrBm structure with KA at the entrance to the active site was used as an initial model to run an extensive non-biased ligand migration simulations with PELE (Protein Energy Landscape Exploration) in a constrained sphere of 20 (from the initial ligand center of mass) 38
This concentration is rare outside of space-constrained shipping situations
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