A natural antibacterial molecule shows clinical promise. Its unusual binding site is on an excellent target: ...

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Six balloons tied together in a bunch arrange themselves in an octahedral fashion. As balloons are popped the resulting number conforms to the molecular shapes of VSEPR theory. To Conduct ...

control of seed-crystal shapes is an important goal. Researchers used two computational approaches, parallel-tempering molecular dynamics (MD) and partial replica exchange MD, to estimate the most ...