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  • Entropy Calculations of Single Molecules by Combining the Rigid-Rotor and Harmonic-Oscillator Approximations with Conformational Entropy Estimations from Molecular Dynamics Simulations [2011]

    Category:
    Artículos
    Authors:
    Ernesto Suárez Álvarez , Natalia Díaz Fernández , Dimas Suárez Rodríguez
    Date:
    01 of January of 2011
    It Is a Part of:
    Journal of Chemical Theory and Computation