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We examine the phase transition of polymer adsorption as well as the underlying kinetics of polymer binding from dilute solutions on a structureless solid surface. The emphasis is put on the properties of regular multiblock copolymers,…

Soft Condensed Matter · Physics 2009-09-03 A. Milchev , V. Rostiashvili , S. Bhattacharya , T. Vilgis

We investigate the feature compression of high-dimensional ridge regression using the optimal subsampling technique. Specifically, based on the basic framework of random sampling algorithm on feature for ridge regression and the A-optimal…

Computation · Statistics 2022-04-19 Hanyu Li , Chengmei Niu

Representational similarity analysis (RSA) has been shown to be an effective framework to characterize brain-activity profiles and deep neural network activations as representational geometry by computing the pairwise distances of the…

Neurons and Cognition · Quantitative Biology 2019-07-30 Baihan Lin , Marieke Mur , Tim Kietzmann , Nikolaus Kriegeskorte

Packing is a complex phenomenon of prominence in many natural and industrial processes (liquid crystals, granular materials, infiltration, melting, flow, sintering, segregation, sedimentation, compaction, etc.). A variety of computational…

Chemical Physics · Physics 2012-05-31 Danilo Sergi , Claudio D'Angelo , Giulio Scocchi , Alberto Ortona

Surface reconstruction with preservation of geometric features is a challenging computer vision task. Despite significant progress in implicit shape reconstruction, state-of-the-art mesh extraction methods often produce aliased,…

Computer Vision and Pattern Recognition · Computer Science 2023-12-01 Natalia Soboleva , Olga Gorbunova , Maria Ivanova , Evgeny Burnaev , Matthias Nießner , Denis Zorin , Alexey Artemov

Many idealized problems in signal processing, machine learning and statistics can be reduced to the problem of finding the symmetric canonical decomposition of an underlying symmetric and orthogonally decomposable (SOD) tensor. Drawing…

Numerical Analysis · Computer Science 2017-05-31 Cun Mu , Daniel Hsu , Donald Goldfarb

We provide novel random surface density functional theory (RSDFT) formulation in the case of geometric heterogeneous surface of solid media which is essential for description of thermodynamic properties of confined fluids. The major…

Statistical Mechanics · Physics 2017-11-22 Timur Aslyamov , Aleksey Khlyupin

Adaptive simulated annealing (ASA) is a global optimization algorithm based on an associated proof that the parameter space can be sampled much more efficiently than by using other previous simulated annealing algorithms. The author's ASA…

Mathematical Software · Computer Science 2007-05-23 Lester Ingber

In this work we present the latest developments in the SAMPA-SRS integration. A software was developed to improve the acquisition configuration, acquisition, and decoding of the data. The complete framework was tested using a triple…

Instrumentation and Detectors · Physics 2023-05-26 G. G. A. de Souza , T. S. Abelha , T. B. Saramela , A. F. V. Cortez , H. N. da Luz , C. G. Penteado , M. Bregant

We introduce deterministic perturbation schemes for the recently proposed random directions stochastic approximation (RDSA) [17], and propose new first-order and second-order algorithms. In the latter case, these are the first second-order…

Optimization and Control · Mathematics 2019-03-29 Prashanth L A , Shalabh Bhatnagar , Nirav Bhavsar , Michael Fu , Steven I. Marcus

We study the adsorption of semiflexible polymers such as polyelectrolytes or DNA on planar and curved substrates, e.g., spheres or washboard substrates via short-range potentials using extensive Monte-Carlo simulations, scaling arguments,…

Soft Condensed Matter · Physics 2015-08-19 Tobias A. Kampmann , Horst-Holger Boltz , Jan Kierfeld

We propose a sampling-based method for computing the tensor ring (TR) decomposition of a data tensor. The method uses leverage score sampled alternating least squares to fit the TR cores in an iterative fashion. By taking advantage of the…

Numerical Analysis · Mathematics 2021-07-12 Osman Asif Malik , Stephen Becker

We have investigated Rb adsorption on the Si(100) surface for 0.5 and 1 monolayer coverages using the total energy method with norm-conserving pseudopotentials. For 2$\times$1 reconstruction at 1 ML coverage symmetrized dimers are found to…

Strongly Correlated Electrons · Physics 2007-05-23 E. Mete , R. Shaltaf , Ş. Ellialtıoğlu

X-ray absorption spectroscopy yields direct access to the electronic and geometric structure of hybrid inorganic-organic interfaces formed upon adsorption of complex molecules at metal surfaces. The unambiguous interpretation of…

Chemical Physics · Physics 2017-06-19 Katharina Diller , Reinhard J. Maurer , Moritz Müller , Karsten Reuter

We develop a behavioural theory of reflective sequential algorithms (RSAs), i.e. sequential algorithms that can modify their own behaviour. The theory comprises a set of language-independent postulates defining the class of RSAs, an…

Logic in Computer Science · Computer Science 2023-01-27 Klaus-Dieter Schewe , Flavio Ferrarotti

Random sequential adsorption of linear and square particles with excluded volume interaction is studied numerically on planar lattices considering Gaussian distributions of lateral sizes of the incident particles, with several values of the…

Statistical Mechanics · Physics 2016-10-03 Rogerio Costa Hart , Fabio David Alves Aarão Reis

Polymer adsorption is a fundamental problem in statistical mechanics that has direct relevance to diverse disciplines ranging from biological lubrication to stability of colloidal suspensions. We combine experiments with computer…

Soft Condensed Matter · Physics 2015-08-07 D. Welch , M. P. Lettinga , M. Ripoll , Z. Dogic , G. A. Vliegenthart

Coherent virtual absorption refers to time-limited storage of optical energy in lossless configurations due to excitation of a complex zero frequency through proper temporal engineering of the incident wave. Given the dynamics underlying…

In this paper the full and exhaustive algorithm of formation of a smooth molecular Solvent Excluded Surface- SES, and also Solvent Accessible Surface- SAS is presented. These surfaces are a boundary between molecule and solvent. The basis…

Chemical Physics · Physics 2013-03-19 Oleg Kupervasser , N. E. Wanner

Motivated by the diversity and complexity of two-dimensional crystals formed by triangular proteins and protein trimers, we have investigated the structures and phase behavior of hard-disk trimers. In order to mimic specific binding…

Soft Condensed Matter · Physics 2009-11-11 Philip J. Camp , Peter D. Duncan
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