173 search results - page 1 / 35 » Free energy computation by controlled Langevin dynamics |
PROCEDIA
2010
13 years 3 months ago
2010
We propose a nonequilibrium sampling method for computing free energy profiles along a given reaction coordinate. The method consists of two parts: a controlled Langevin sampler ...
CANDC
2007
ACM
13 years 4 months ago
2007
ACM
Although the mechanisms of eukaryotic chromosome segregation and cell division have been elucidated to a certain extent, those for bacteria remain largely unknown. Here we present...
JCC
2006
13 years 4 months ago
2006
: We describe the implementation of a general and flexible Monte Carlo (MC) module for the program CHARMM, which is used widely for modeling biomolecular systems with empirical ene...
JAIR
2011
12 years 7 months ago
2011
We address the problem of computing approximate marginals in Gaussian probabilistic models by using mean field and fractional Bethe approximations. We define the Gaussian fracti...
ICCV
2009
IEEE
14 years 9 months ago
2009
IEEE
Current state-of-the-art image-based scene reconstruction
techniques are capable of generating high-fidelity 3D
models when used under controlled capture conditions.
However, th...