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Statistical potential

Known as: Empirical potential, Knowledge-based potential, Residue contact potential 
In protein structure prediction, a statistical potential or knowledge-based potential is an energy function derived from an analysis of known protein… Expand
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Papers overview

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Highly Cited
2016
Highly Cited
2016
Density functional theory offers a very accurate way of computing materials properties from first principles. However, it is too… Expand
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Highly Cited
2014
Highly Cited
2014
On-chip parity–time-symmetric optics is experimentally demonstrated at a wavelength of 1,550 nm in two directly coupled, high-Q… Expand
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Highly Cited
2013
Highly Cited
2013
We present a parameterization of the Stillinger-Weber potential to describe the interatomic interactions within single-layer MoS2… Expand
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Highly Cited
2010
Highly Cited
2010
We have examined the commonly used Tersoff and Brenner empirical interatomic potentials in the context of the phonon dispersions… Expand
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Highly Cited
2009
Highly Cited
2009
An analytic formula is derived for the elastic bending modulus of monolayer graphene based on an empirical potential for solid… Expand
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Highly Cited
2002
Highly Cited
2002
Earlier studies (Singh and Xu, 1997; Xu and Singh, 2000, 2001) have evaluated and compared various popular empirical… Expand
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Highly Cited
2000
Highly Cited
2000
A potential function is presented that can be used to model both chemical reactions and intermolecular interactions in condensed… Expand
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Highly Cited
2000
Highly Cited
2000
Improvements in the CHARMM all-atom force field for atomic-level molecular simulations of lipids are reported. Substantial… Expand
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Highly Cited
1997
Highly Cited
1997
Abstract Most biological substrates have distinctive sizes, shapes, and charge distributions which can be recognized specifically… Expand
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Highly Cited
1994
Highly Cited
1994
A global optimization algorithm is proposed for finding the global minimum potential energy conformations of small molecules. The… Expand
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