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Computer Simulation (Latest Articles)
Latest indexed articles for 'Computer Simulation'
Articles 171 to 180 of 200:
30 Aug 2009
The classical receptive fields of simple cells in mammalian primary visual cortex demonstrate three cardinal response properties: (1) they do not respond to stimuli that are spatially homogeneous; (2) they respond best to stimuli in a preferred ...
rec_pub_19721693-simple-cell-response-properties-imply-receptive-field-structure.htm
30 Aug 2009
On the basis of the vector Rayleigh-Sommerfeld diffraction integrals, the analytical expression for Gaussian vortex beams diffracted at a half-plane screen beyond the paraxial approximation is derived and used to study the polarization singularities ...
rec_pub_19721680-polarization-singularities-gaussian-vortex-beams-diffracted-half.htm
Subspace-based optimization method for reconstructing extended scatterers: transverse electric case.
30 Aug 2009
The subspace-based optimization method is generalized to the transverse electric (TE) case for reconstructing the relative-permittivity profiles of extended scatterers. The essence of the subspace-based optimization method is that part of the ...
rec_pub_19721676-subspace-based-optimization-method-reconstructing-extended-scatterers.htm
Self-guided Langevin dynamics study of regulatory interactions in NtrC.
30 Aug 2009
Multiple self-guided Langevin dynamics (SGLD) simulations were performed to examine structural and dynamical properties of the receiver domain of nitrogen regulatory protein C (NtrC(r)). SGLD and MD simulations of the phosphorylated active form ...
rec_pub_19384996-self-guided-langevin-dynamics-study-regulatory-interactions-ntrc.htm
30 Aug 2009
The conformational dynamics of the I-like and Hybrid domains from the beta3 integrin headpiece were studied by molecular dynamics simulation and normal mode analysis. Crystallographic structures of integrins show that the integrin headpiece can ...
rec_pub_19350618-dynamics-beta3-integrin-like-hybrid-domains-insight-simulations.htm
Identification of protein functional surfaces by the concept of a split pocket.
30 Aug 2009
The function of a protein is often fulfilled via molecular interactions on its surfaces, so identifying the functional surface(s) of a protein is helpful for understanding its function. Here, we introduce the concept of a split pocket, which is a ...
rec_pub_19326458-identification-protein-functional-surfaces-concept-split-pocket.htm
Building and assessing atomic models of proteins from structural templates: learning and benchmarks.
30 Aug 2009
One approach to predict a protein fold from a sequence (a target) is based on structures of related proteins that are used as templates. We present an algorithm that examines a set of candidates for templates, builds from each of the templates an ...
rec_pub_19326457-building-assessing-atomic-models-proteins-structural-templates.htm
30 Aug 2009
A new and very promising strategy for HIV drug discovery consists in blocking the multiple functional interactions between HIV-1 integrase (IN) and its cellular cofactors. At present, this line of action is hindered by the absence of ...
rec_pub_19306343-complexes-hiv-1-integrase-hat-proteins-multiscale-models-dynamics.htm
30 Aug 2009
Protein-protein interactions are mediated by complementary amino acids defining complementary surfaces. Typically not all members of a family of related proteins interact equally well with all members of a partner family; thus analysis of the ...
rec_pub_19306342-graphical-models-protein-protein-interaction-specificity-correlated.htm
Free-energy profiles for ions in the influenza M2-TMD channel.
30 Aug 2009
M(2) transmembrane domain channel (M(2)-TMD) permeation properties are studied using molecular dynamics simulations of M(2)-TMD (1NYJ) embedded in a lipid bilayer (DMPC) with 1 mol/kg NaCl or KCl saline solution. This study allows examination of ...
rec_pub_19296508-free-energy-profiles-ions-influenza-m2-tmd-channel.htm
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