8 search results - page 1 / 2 » Quantum correction to the pair distribution function |
JCC
2007
13 years 4 months ago
2007
: We report a numerical technique that allows the quantum effects of zero-point motion to be incorporated into Pair Distribution Functions calculated classically for molecules usin...
JCC
2007
13 years 4 months ago
2007
: This paper first comments on the surprisingly poor status that Quantum Chemistry has offered to the fantastic intuition of Lewis concerning the distribution of the electrons in ...
COCOON
2008
Springer
13 years 6 months ago
2008
Springer
This paper describes a general quantum lower bounding technique for the communication complexity of a function that depends on the inputs given to two parties connected via paths,...
BMCBI
2010
2010
Orientation-dependent backbone-only residue pair scoring functions for fixed backbone protein design
13 years 4 months ago
Background: Empirical scoring functions have proven useful in protein structure modeling. Most such scoring functions depend on protein side chain conformations. However, backbone...
SETA
2004
Springer
13 years 9 months ago
2004
Springer
Abstract. Merit factor of a binary sequence is reviewed, and constructions are described that appear to satisfy an asymptotic merit factor of 6.3421 . . . Multivariate merit factor...