Results 21 to 30 of about 55 (55)
NMR Protein Structure Calculation and Sphere Intersections
Computational and Mathematical Biophysics, 2020 Nuclear Magnetic Resonance (NMR) experiments can be used to calculate 3D protein structures and geometric properties of protein molecules allow us to solve the problem iteratively using a combinatorial method, called Branch-and-Prune (BP).
Lavor Carlile +3 more
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The Minimum Harmonic Index for Unicyclic Graphs with Given Diameter
Discussiones Mathematicae Graph Theory, 2018 The harmonic index of a graph G is defined as the sum of the weights 2d(u)+d(v)${2 \over {d(u) + d(v)}}$ of all edges uv of G, where d(u) denotes the degree of a vertex u in G.
Zhong Lingping
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Injectivity results for coarse homology theories
Proceedings of the London Mathematical Society, Volume 121, Issue 6, Page 1619-1684, December 2020., 2020 Abstract We show injectivity results for assembly maps using equivariant coarse homology theories with transfers. Our method is based on the descent principle and applies to a large class of linear groups or, more generally, groups with finite decomposition complexity.
Ulrich Bunke +3 more
wiley +1 more source
The Smallest Harmonic Index of Trees with Given Maximum Degree
Discussiones Mathematicae Graph Theory, 2018 The harmonic index of a graph G, denoted by H(G), is defined as the sum of weights 2/[d(u) + d(v)] over all edges uv of G, where d(u) denotes the degree of a vertex u. In this paper we establish a lower bound on the harmonic index of a tree T.
Rasi Reza, Sheikholeslami Seyed Mahmoud
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Homotopy type of the complex of free factors of a free group
Proceedings of the London Mathematical Society, Volume 121, Issue 6, Page 1737-1765, December 2020., 2020 Abstract We show that the complex of free factors of a free group of rank n⩾2 is homotopy equivalent to a wedge of spheres of dimension n−2. We also prove that for n⩾2, the complement of (unreduced) Outer space in the free splitting complex is homotopy equivalent to the complex of free factor systems and moreover is (n−2)‐connected.
Benjamin Brück, Radhika Gupta
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CBSF: A New Empirical Scoring Function for Docking Parameterized by Weights of Neural Network
Computational and Mathematical Biophysics, 2019 A new CBSF empirical scoring function for the estimation of binding energies between proteins and small molecules is proposed in this report. The final score is obtained as a sum of three energy terms calculated using descriptors based on a simple ...
Syrlybaeva Raulia R., Talipov Marat R.
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The Weighted Mean Curvature Derivative of a Space-Filling Diagram
Computational and Mathematical Biophysics, 2020 Representing an atom by a solid sphere in 3-dimensional Euclidean space, we get the space-filling diagram of a molecule by taking the union. Molecular dynamics simulates its motion subject to bonds and other forces, including the solvation free energy ...
Akopyan Arsenyi, Edelsbrunner Herbert
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When products of projections diverge
Journal of the London Mathematical Society, Volume 102, Issue 1, Page 345-367, August 2020., 2020 Abstract Slow convergence of cyclic projections implies divergence of random projections and vice versa. Let L1,L2,⋯,LK be a family of K closed subspaces of a Hilbert space. It is well known that although the cyclic product of the orthogonal projections on these spaces always converges in norm, random products might diverge.
Eva Kopecká
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Decomposing tournaments into paths
Proceedings of the London Mathematical Society, Volume 121, Issue 2, Page 426-461, August 2020., 2020 Abstract We consider a generalisation of Kelly's conjecture which is due to Alspach, Mason, and Pullman from 1976. Kelly's conjecture states that every regular tournament has an edge decomposition into Hamilton cycles, and this was proved by Kühn and Osthus for large tournaments. The conjecture of Alspach, Mason, and Pullman asks for the minimum number
Allan Lo +3 more
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Untwisting 3‐strand torus knots
Bulletin of the London Mathematical Society, Volume 52, Issue 3, Page 429-436, June 2020., 2020 Abstract We prove that the signature bound for the topological 4‐genus of 3‐strand torus knots is sharp, using McCoy's twisting method. We also show that the bound is off by at most 1 for 4‐strand and 6‐strand torus knots, and improve the upper bound on the asymptotic ratio between the topological 4‐genus and the Seifert genus of torus knots from 2/3 ...
S. Baader, I. Banfield, L. Lewark
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