Concepedia

Binding and intracellular transport of 25-hydroxycholesterol by Niemann-Pick C2 protein

Daniel C. Petersen, Peter Reinholdt, Maria Szomek, Selina Hansen, Vasanthanathan Poongavanam, Alice Dupont, Christian W. Heegaard, Kathiresan Krishnan, Hideji Fujiwara, Douglas F. Covey,

Biochimica et Biophysica Acta (BBA) - Biomembranes · 2019 · 17 citations · 65 references

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Concepts

References

65

A consistent and accurate<i>ab initio</i>parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu

Stefan Grimme, Jens Antony, Stephan Ehrlich et al. · The Journal of Chemical Physics · 2010 · 53.8K citations

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Molecular dynamics with coupling to an external bath

Herman J. C. Berendsen, Johan P. M. Postma, Wilfred F. van Gunsteren et al. · The Journal of Chemical Physics · 1984 · 30.3K citations · Full text

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Particle mesh Ewald: An <i>N</i>⋅log(<i>N</i>) method for Ewald sums in large systems

Tom Darden, Darrin M. York, Lee G. Pedersen · The Journal of Chemical Physics · 1993 · 29.8K citations · Full text

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Effect of the damping function in dispersion corrected density functional theory

Stefan Grimme, Stephan Ehrlich, Lars Goerigk · Journal of Computational Chemistry · 2011 · 25.5K citations

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Development and testing of a general amber force field

Junmei Wang, Romain M. Wolf, James W. Caldwell et al. · Journal of Computational Chemistry · 2004 · 18.8K citations

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