most citedFull dimensional (15D) quantum-dynamical simulation of the protonated water-dimer II: infrared spectrum and vibrational dynamics

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cond-mat.other2008★ 1 cited

Lipid thermodynamics : melting is molecular

Sailaja Krishnamurty, Milen Stefanov, Tzonka Mineva +5

This computational experiment demonstrates that chain melting in lipids is a molecular process. BOMD is certainly the best method to reproduce such dynamics properties, since the e…