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Atomistic or ab-initio molecular dynamics simulations are widely used to predict thermodynamics and kinetics and relate them to molecular structure. A common approach to go beyond the time- and length-scales accessible with such…

Discrete forms of the mean and directed curvature are constructed on piecewise flat manifolds, providing local curvature approximations for smooth manifolds embedded in both Euclidean and non-Euclidean spaces. The resulting expressions take…

Differential Geometry · Mathematics 2023-04-04 Rory Conboye

The aim of this paper is to extend classic results of the theory of CMC surfaces in the product spaces to the class of immersed surfaces in $\mathbb{M}^2(\kappa)\times\mathbb{R}$ whose mean curvature is given as a $C^1$ function depending…

Differential Geometry · Mathematics 2018-07-31 Antonio Bueno

We consider constant mean curvature surfaces of finite topology, properly embedded in three-space in the sense of Alexandrov. Such surfaces with three ends and genus zero were constructed and completely classified by the authors in…

Differential Geometry · Mathematics 2007-12-05 Karsten Grosse-Brauckmann , Robert B. Kusner , John M. Sullivan

In this paper, we introduce a definition of discrete conformality for triangulated surfaces with flat cone metrics and describe an algorithm for solving the problem of prescribing curvature, that is to deform the metric discrete conformally…

Computational Geometry · Computer Science 2014-12-23 Jian Sun , Tianqi Wu , Xianfeng Gu , Feng Luo

Multiscale molecular modeling is widely applied in scientific research of molecular properties over large time and length scales. Two specific challenges are commonly present in multiscale modeling, provided that information between the…

Computational Physics · Physics 2024-07-23 Jun Zhang , Xiaohan Lin , Weinan E , Yi Qin Gao

A degree-regular triangulation is one in which each vertex has identical degree. Our main result is that any such triangulation of a (possibly non-compact) surface $S$ is geometric, that is, it is combinatorially equivalent to a geodesic…

Combinatorics · Mathematics 2017-11-06 Basudeb Datta , Subhojoy Gupta

Point cloud compression (PCC) is a key enabler for various 3-D applications, owing to the universality of the point cloud format. Ideally, 3D point clouds endeavor to depict object/scene surfaces that are continuous. Practically, as a set…

Image and Video Processing · Electrical Eng. & Systems 2022-09-12 Jiahao Pang , Muhammad Asad Lodhi , Dong Tian

We determine the gonality and the Clifford index for curves on a compact smooth toric surface. Moreover, it is shown that their gonality are computed by pencils on the ambient surface. From the geometrical view point, this means that the…

Algebraic Geometry · Mathematics 2013-10-22 Ryo Kawaguchi

We introduce an intrinsic estimator for the scalar curvature of a data set presented as a finite metric space. Our estimator depends only on the metric structure of the data and not on an embedding in $\mathbb{R}^n$. We show that the…

Machine Learning · Statistics 2023-08-14 Abigail Hickok , Andrew J. Blumberg

We present a new approach to coarse-graining of variables describing dust flow in GR. It is based on assigning quasi-local shear, twist and expansion to 2-dimensional surfaces with the help of isometric embeddings into the 3-dimensional…

General Relativity and Quantum Cosmology · Physics 2015-05-14 Mikolaj Korzynski

We study numerical computation of conformal invariants of domains in the complex plane. In particular, we provide an algorithm for computing the conformal capacity of a condenser. The algorithm applies for wide kind of geometries: domains…

Complex Variables · Mathematics 2020-08-19 Mohamed M S Nasser , Matti Vuorinen

Coarse-grained (CG) molecular dynamics (MD) simulations can simulate large molecular complexes over extended timescales by reducing degrees of freedom. A critical step in CG modeling is the selection of the CG mapping algorithm, which…

Soft Condensed Matter · Physics 2025-07-23 Soumya Mondal , Subhanu Halder , Debarchan Basu , Sandeep Kumar , Tarak Karmakar

Recent developments for mathematical modeling and numerical simulation of biomolecular systems raise new demands for qualified, stable, and efficient surface meshing, especially in implicit-solvent modeling. In our former work, we have…

Numerical Analysis · Mathematics 2016-11-11 Tiantian Liu , Minxin Chen , Benzhuo Lu

Families of conformal field theories are naturally endowed with a Riemannian geometry which is locally encoded by correlation functions of exactly marginal operators. We show that the curvature of such conformal manifolds can be computed…

High Energy Physics - Theory · Physics 2023-08-09 Bruno Balthazar , Clay Cordova

The Minkowski tensors are the natural tensor-valued generalizations of the intrinsic volumes of convex bodies. We prove two complete sets of integral geometric formulae, so called kinematic and Crofton formulae, for these Minkowski tensors.…

Metric Geometry · Mathematics 2017-12-29 Daniel Hug , Jan A. Weis

In this paper, we are concerned with the recovery of the geometric shapes of inhomogeneous inclusions from the associated far field data in electrostatics and acoustic scattering. We present a local resolution analysis and show that the…

Analysis of PDEs · Mathematics 2021-08-17 Habib Ammari , Yat Tin Chow , Hongyu Liu

We obtain compact orientable embedded surfaces with constant mean curvature $0<H<\frac{1}{2}$ and arbitrary genus in $\mathbb{S}^2\times\mathbb{R}$. These surfaces have dihedral symmetry and desingularize a pair of spheres with mean…

Differential Geometry · Mathematics 2021-01-05 José M. Manzano , Francisco Torralbo

A regularization procedure developed in [1] for the integral curvature invariants on manifolds with conical singularities is generalized to the case of squashed cones. In general, the squashed conical singularities do not have rotational…

High Energy Physics - Theory · Physics 2015-06-16 Dmitri V. Fursaev , Alexander Patrushev , Sergey N. Solodukhin

The existing convolutional neural network pruning algorithms can be divided into two categories: coarse-grained clipping and fine-grained clipping. This paper proposes a coarse and fine-grained automatic pruning algorithm, which can achieve…

Computer Vision and Pattern Recognition · Computer Science 2020-10-15 Jingfei Chang