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Inverse protein folding -- the task of predicting a protein sequence from its backbone atom coordinates -- has surfaced as an important problem in the "top down", de novo design of proteins. Contemporary approaches have cast this problem as…

We mimic random nanowire networks by the homogeneous, isotropic, and random deposition of conductive zero-width sticks onto an insulating substrate. The number density (the number of objects per unit area of the surface) of these sticks is…

Statistical Mechanics · Physics 2021-07-02 Yuri Yu. Tarasevich , Andrei V. Eserkepov , Renat K. Akhunzhanov , Mikhail V. Ulyanov

We propose a new method for shape recognition and retrieval based on dynamic programming. Our approach uses the dynamic programming algorithm to compute the optimal score and to find the optimal alignment between two strings. First, each…

Computer Vision and Pattern Recognition · Computer Science 2019-05-01 Noreddine Gherabi , Bahaj Mohamed

Object Skeletonization is the process of extracting skeletal, line-like representations of shapes. It provides a very useful tool for geometric shape understanding and minimal shape representation. It also has a wide variety of…

Computer Vision and Pattern Recognition · Computer Science 2021-12-23 Mohamed A. Ghanem , Alaa A. Anani

General object detectors use powerful backbones that uniformly extract features from images for enabling detection of a vast amount of object types. However, utilization of such backbones in object detection applications developed for…

Computer Vision and Pattern Recognition · Computer Science 2021-08-04 Alexandra Dana , Maor Shutman , Yotam Perlitz , Ran Vitek , Tomer Peleg , Roy J Jevnisek

Continuum robots have emerged as a promising technology in the medical field due to their potential of accessing deep sited locations of the human body with low surgical trauma. When deriving physics-based models for these robots,…

Robotics · Computer Science 2024-05-27 Matthias K. Hoffmann , Julian Mühlenhoff , Zhaoheng Ding , Thomas Sattel , Kathrin Flaßkamp

Identifying local structural motifs and packing patterns of molecular solids is a challenging task for both simulation and experiment. We demonstrate two novel approaches to characterize local environments in different polymorphs of…

Materials Science · Physics 2024-04-02 Daisuke Kuroshima , Michael Kilgour , Mark E. Tuckerman , Jutta Rogal

In order to investigate the dependence on lattice size of several observables in percolation, the Hoshen-Kopelman algorithm was modified so that growing lattices could be simulated. By this way, when simulating a lattice of size L, lattices…

Statistical Mechanics · Physics 2009-11-11 Daniel Tiggemann

Developments of nonlocal operators for modeling processes that traditionally have been described by local differential operators have been increasingly active during the last few years. One example is peridynamics for brittle materials and…

Numerical Analysis · Mathematics 2020-04-06 Xiaochuan Tian , Bjorn Engquist

Similarity search is one of the most fundamental computations that are regularly performed on ever-increasing protein datasets. Scalability is of paramount importance for uncovering novel phenomena that occur at very large scales. We…

Distributed, Parallel, and Cluster Computing · Computer Science 2023-03-06 Oguz Selvitopi , Saliya Ekanayake , Giulia Guidi , Muaaz G. Awan , Georgios A. Pavlopoulos , Ariful Azad , Nikos Kyrpides , Leonid Oliker , Katherine Yelick , Aydın Buluç

We study the statistics of the backbone cluster between two sites separated by distance $r$ in two-dimensional percolation networks subjected to spatial long-range correlations. We find that the distribution of backbone mass follows the…

Statistical Mechanics · Physics 2012-08-27 A. D. Araújo , A. A. Moreira , R. N. Costa Filho , J. S. Andrade,

Predicting the structure of multi-protein complexes is a grand challenge in biochemistry, with major implications for basic science and drug discovery. Computational structure prediction methods generally leverage pre-defined structural…

Biomolecules · Quantitative Biology 2021-01-26 Stephan Eismann , Raphael J. L. Townshend , Nathaniel Thomas , Milind Jagota , Bowen Jing , Ron O. Dror

Reconstructing the 3D location and size of microparticles from diffraction images - holograms - is a computationally expensive inverse problem that has traditionally been solved using physics-based reconstruction methods. More recently,…

Computer Vision and Pattern Recognition · Computer Science 2025-03-17 Ayush Paliwal , Oliver Schlenczek , Birte Thiede , Manuel Santos Pereira , Katja Stieger , Eberhard Bodenschatz , Gholamhossein Bagheri , Alexander Ecker

In an effort to explore high-throughput processing of microscopic image data, a method based on deep convolutional neural network is proposed. The state-of-the-art computer vision algorithm, Faster R-CNN, was trained for the detection of…

Disordered Systems and Neural Networks · Physics 2021-03-09 Ze-Bin Wu

We describe new approaches for distances between pairs of 2-dimensional surfaces (embedded in 3-dimensional space) that use local structures and global information contained in inter-structure geometric relationships. We present algorithms…

Numerical Analysis · Mathematics 2015-05-30 D. Boyer , Y. Lipman , E. St. Clair , J. Puente , T. Funkhouser , B. Patel , J. Jernvall , I. Daubechies

The central problem of concern to Serrano, Boguna and Vespignani ("Extracting the multiscale backbone of complex weighted networks", Proc Natl Acad Sci 106:6483-6488 [2009]) can be effectively and elegantly addressed using a…

Physics and Society · Physics 2012-07-03 Paul B. Slater

Fractal dimension is widely adopted in spatial databases and data mining, among others as a measure of dataset skewness. State-of-the-art algorithms for estimating the fractal dimension exhibit linear runtime complexity whether based on…

Databases · Computer Science 2009-05-27 Christos Attikos , Michael Doumpos

The backbone of a Boolean formula is the set of literals that must be true in every assignment that satisfies the formula. This concept is fundamental to key operations on variability models, including propagating user configuration…

Software Engineering · Computer Science 2026-03-18 Luis Cambelo , Ruben Heradio , Jose-Miguel Horcas , Dictino Chaos , David Fernandez-Amoros

Computational protein design has a wide variety of applications. Despite its remarkable success, designing a protein for a given structure and function is still a challenging task. On the other hand, the number of solved protein structures…

Quantitative Methods · Quantitative Biology 2018-04-26 Jingxue Wang , Huali Cao , John Z. H. Zhang , Yifei Qi

Model-based learned iterative reconstruction methods have recently been shown to outperform classical reconstruction algorithms. Applicability of these methods to large scale inverse problems is however limited by the available memory for…

Image and Video Processing · Electrical Eng. & Systems 2020-04-21 Andreas Hauptmann , Jonas Adler , Simon Arridge , Ozan Öktem