Interpolating an arbitrary number of joint B-spline curves by Loop surfaces Fulltext Access 8 Pages 2012
Triangulated manifold meshing method preserving molecular surface topology Fulltext Access 8 Pages 2012
A theoretical study of structural and electronic properties of pentacene/Al(1 0 0) interface Fulltext Access 8 Pages 2012
Computational study: How redox affect the nonlinear optical properties of donor substituted heteroleptic bis-tridentate Ru(II) complexes? Fulltext Access 8 Pages 2012
Targeting essential cell wall lipase Rv3802c for potential therapeutics against tuberculosis Fulltext Access 8 Pages 2012
Molecular dynamics simulation of the interaction between protein tyrosine phosphatase 1B and aryl diketoacid derivatives Fulltext Access 8 Pages 2012
Gn-blending of multiple parametric normal ringed surfaces by adding implicit closings Gn-continuous with the surfaces Fulltext Access 8 Pages 2012
Substituent effects on zinc phthalocyanine derivatives: A theoretical calculation and screening of sensitizer candidates for dye-sensitized solar cells Fulltext Access 8 Pages 2012
Molecular modeling of the lipase-catalyzed hydrolysis of acetoxymethyl(i-propoxy)phenylphosphine oxide and its P-borane analogue Fulltext Access 8 Pages 2012
Progressive encoding and compression of surfaces generated from point cloud data Fulltext Access 8 Pages 2012
SPACESKETCH: Shape modeling with 3D meshes and control curves in stereoscopic environments Fulltext Access 8 Pages 2012
Calculating the Na+ translocating V-ATPase catalytic site affinity for substrate binding by homology modeled NtpA monomer using molecular dynamics/free energy calculation Fulltext Access 8 Pages 2012
Probing the simulant behavior of PNPDPP toward parathion and paraoxon: A computational study Fulltext Access 8 Pages 2012
Energies and physicochemical properties of cation–π interactions in biological structures Fulltext Access 8 Pages 2012
Ensemble fits of restrained peptides’ conformational equilibria to NMR data. Dependence on force fields: AMBER/8 ff03 versus ECEPP/3 Fulltext Access 8 Pages 2012
The structure–property relationship of chiral 1,1′-binaphthyl-based polyoxometalates: TDDFT studies on the static first hyperpolarizabilities and the ECD spectra Fulltext Access 8 Pages 2012
Computational study on the inhibition mechanism of cruzain by nitrile-containing molecules Fulltext Access 8 Pages 2012
Virtual Network Marathon with immersion, scientificalness, competitiveness, adaptability and learning Fulltext Access 8 Pages 2012
High-level application development for non-computer science majors using image processing Fulltext Access 8 Pages 2012
Hole filling of triangular mesh segments using systematic grey prediction Fulltext Access 8 Pages 2012
Mitral annulus segmentation from four-dimensional ultrasound using a valve state predictor and constrained optical flow Fulltext Access 8 Pages 2012
Comparative modeling of human kappa opioid receptor and docking analysis with the peptide YFa Fulltext Access 8 Pages 2012
Substituent effects on the structure–property relationship of unsymmetrical methyloxy and methoxycarbonyl phthalocyanines: DFT and TDDFT theoretical studies Fulltext Access 9 Pages 2012
A fast analysis method for non-invasive imaging of blood flow in individual cerebral arteries using vessel-encoded arterial spin labelling angiography Fulltext Access 9 Pages 2012
A novel deformation method for fast simulation of biological tissue formed by fibers and fluid Fulltext Access 9 Pages 2012
A finite-element approach to the direct computation of relative cardiovascular pressure from time-resolved MR velocity data Fulltext Access 9 Pages 2012
Formulas and algorithms for quantum differentiation of quantum Bernstein bases and quantum Bézier curves based on quantum blossoming Fulltext Access 9 Pages 2012
The C-terminal domain of the 2b protein of Cucumber mosaic virus is stabilized by divalent metal ion coordination Fulltext Access 9 Pages 2012
Efficient globally optimal segmentation of cells in fluorescence microscopy images using level sets and convex energy functionals Fulltext Access 9 Pages 2012
Symmetric positive semi-definite Cartesian Tensor fiber orientation distributions (CT-FOD) Fulltext Access 9 Pages 2012
Brain tissue segmentation in MR images based on a hybrid of MRF and social algorithms Fulltext Access 9 Pages 2012
The origin of the unusual broad and intense visible absorption of tetrathiafulvalene-annulated zinc porphyrazine: A density functional theory study Fulltext Access 9 Pages 2012
Results of molecular docking as descriptors to predict human serum albumin binding affinity Fulltext Access 9 Pages 2012
Investigation of a predicted N-terminal amphipathic α-helix using atomistic molecular dynamics simulation of a complete prototype poliovirus virion Fulltext Access 9 Pages 2012
Efficient mobile AR technology using scalable recognition and tracking based on server-client model Fulltext Access 9 Pages 2012
Coupled motions during dynamics reveal a tunnel toward the active site regulated by the N-terminal α-helix in an acylaminoacyl peptidase Fulltext Access 9 Pages 2012
Structural analysis of Ca2+ dependent and Ca2+ independent type II antifreeze proteins: A comparative molecular dynamics simulation study Fulltext Access 9 Pages 2012
A high-capacity data-hiding approach for polygonal meshes using maximum expected level tree Fulltext Access 9 Pages 2012
A procedural method to exchange editable 3D data from a free-hand 2D sketch modeling system into 3D mechanical CAD systems Fulltext Access 9 Pages 2012
Computational modeling of effects of intravascular stent design on key mechanical and hemodynamic behavior Fulltext Access 9 Pages 2012
An integrated parameterized tool for designing a customized tracheal stent Fulltext Access 9 Pages 2012
Minimizing the maximum curvature of quadratic Bézier curves with a tetragonal concave polygonal boundary constraint Fulltext Access 9 Pages 2012
Family of superspirals with completely monotonic curvature given in terms of Gauss hypergeometric function Fulltext Access 9 Pages 2012
A practical approach for real-time illumination estimation of outdoor videos Fulltext Access 9 Pages 2012
Construction of a robust, large-scale, collaborative database for raw data in computational chemistry: The Collaborative Chemistry Database Tool (CCDBT) Fulltext Access 9 Pages 2012
Theoretical design and screening of panchromatic phthalocyanine sensitizers derived from TT1 for dye-sensitized solar cells Fulltext Access 9 Pages 2012
A hybrid computer-aided linkage design system for tracing open and closed planar curves Fulltext Access 10 Pages 2012
Nonlinear dimensionality reduction and mapping of compound libraries for drug discovery Fulltext Access 10 Pages 2012
Improved initialisation for centroidal Voronoi tessellation and optimal Delaunay triangulation Fulltext Access 10 Pages 2012
User-interface design for the Ripoll Monastery exhibition at the National Art Museum of Catalonia Fulltext Access 10 Pages 2012
Fast virtual deployment of self-expandable stents: Method and in vitro evaluation for intracranial aneurysmal stenting Fulltext Access 10 Pages 2012
Real-time interactive modeling and scalable multiple object tracking for AR Fulltext Access 10 Pages 2012
Molecular dynamics simulations of the coenzyme induced conformational changes of Mycobacterium tuberculosisl-alanine dehydrogenase Fulltext Access 10 Pages 2012
Toward understanding the molecular basis for chemical allosteric modulator design Fulltext Access 10 Pages 2012
Quantitative analysis of molecular surface based on improved Marching Tetrahedra algorithm Fulltext Access 10 Pages 2012