Z-matrix (chemistry)

Known as: Internal coordinate, Internal coordinates, Z-matrix 
In chemistry, the Z-matrix is a way to represent a system built of atoms. A Z-matrix is also known as an internal coordinate representation. It… (More)
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Papers overview

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Highly Cited
2012
Highly Cited
2012
Flexible docking and scoring using the internal coordinate mechanics software (ICM) was benchmarked for ligand binding mode… (More)
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2011
2011
The present study explores the structural, elastic, electronic and optical properties of the newly synthesized monoclinic Zintl… (More)
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Highly Cited
2008
Highly Cited
2008
Live-cell imaging by light microscopy has demonstrated that all cells are spatially and temporally organized. Quantitative… (More)
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Highly Cited
2004
Highly Cited
2004
Reduced computer modeling of proteins now has a history of about 30 years. In spite of the enormous increase in computing… (More)
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Highly Cited
2003
Highly Cited
2003
Hybrid energy methods such as QM/MM and ONIOM, that combine different levels of theory into one calculation, have been very… (More)
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2002
2002
Many of the crystals in the pharmaceuticals, photographic, and other industries are multidimensional; that is, their growth is… (More)
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Highly Cited
2001
Highly Cited
2001
High dimensional data that lies on or near a low dimensional manifold can be described by a collection of local linear models… (More)
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Highly Cited
2000
Highly Cited
2000
  • Ralph Blumenhagen, Lars Goerlich, Boris Kors
  • 2000
We study a new class of N=1 supersymmetric orientifolds in six space-time dimensions. The world-sheet parity transformation is… (More)
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Highly Cited
1997
Highly Cited
1997
  • Bernd G. Pfrommer, Michel Côté, Steven G. Louie, Marvin L. Cohen
  • 1997
A quasi-Newton Method is used to simultaneously relax the internal coordinates and lattice parameters of crystals under pressure… (More)
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1989
1989
There are many ways in which a system can be adjusted to compensate for an overloaded line. Earlier studies have shown that… (More)
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