electron density

 

Topic mentions per year

Topic mentions per year

1950-2017
020040060080019502016

Papers overview

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Highly Cited
2010
Highly Cited
2010
MOLREP is an automated program for molecular replacement that utilizes a number of original approaches to rotational and… (More)
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Highly Cited
2009
Highly Cited
2009
We present a new continuum solvation model based on the quantum mechanical charge density of a solute molecule interacting with a… (More)
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Highly Cited
2009
Highly Cited
2009
We present a parameter-free method for an accurate determination of long-range van der Waals interactions from mean-field… (More)
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Highly Cited
2008
Highly Cited
2008
The PHENIX AutoBuild wizard is a highly automated tool for iterative model building, structure refinement and density… (More)
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Highly Cited
2005
Highly Cited
2005
The hydrates of Cu+, Ag+, CuS-, AgS-, Cu2S, and Ag2S were investigated with density functional theory (DFT), solvent field, and… (More)
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Highly Cited
2000
Highly Cited
2000
A likelihood-based approach to density modification is developed that can be applied to a wide variety of cases where some… (More)
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Highly Cited
1999
Highly Cited
1999
Xfit is a model-building and map viewing program in XtalView that is used by the structural biology community including… (More)
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Highly Cited
1999
Highly Cited
1999
In protein crystallography, much time and effort are often required to trace an initial model from an interpretable electron… (More)
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Highly Cited
1991
Highly Cited
1991
Map interpretation remains a critical step in solving the structure of a macromolecule. Errors introduced at this early stage may… (More)
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Highly Cited
1988
Highly Cited
1988
 
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