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» A Computational Complexity Theory in Membrane Computing
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JCC
2002
127views more  JCC 2002»
14 years 9 months ago
Effective Born radii in the generalized Born approximation: The importance of being perfect
: Generalized Born (GB) models provide, for many applications, an accurate and computationally facile estimate of the electrostatic contribution to aqueous solvation. The GB models...
Alexey Onufriev, David A. Case, Donald Bashford
STACS
2010
Springer
15 years 4 months ago
Branching-time Model Checking of One-counter Processes
One-counter processes (OCPs) are pushdown processes which operate only on a unary stack alphabet. We study the computational complexity of model checking computation tree logic (CT...
Stefan Göller, Markus Lohrey
JCC
2007
79views more  JCC 2007»
14 years 9 months ago
Interfacing Q-Chem and CHARMM to perform QM/MM reaction path calculations
Abstract: A hybrid quantum mechanical/molecular mechanical (QM/MM) potential energy function with HartreeFock, density functional theory (DFT), and post-HF (RIMP2, MP2, CCSD) capab...
H. Lee Woodcock III, Milan Hodoscek, Andrew T. B. ...
CCA
2009
Springer
15 years 4 months ago
Separations of Non-monotonic Randomness Notions
In the theory of algorithmic randomness, several notions of random sequence are defined via a game-theoretic approach, and the notions that received most attention are perhaps Mar...
Laurent Bienvenu, Rupert Hölzl, Thorsten Kr&a...
CASC
2006
Springer
128views Mathematics» more  CASC 2006»
15 years 1 months ago
New Domains for Applied Quantifier Elimination
We address various aspects of our computer algebra-based computer logic system redlog. There are numerous examples in the literature for successful applications of redlog to practi...
Thomas Sturm