Replicated Computational Results (RCR) Report for “Fast Random Integer Generation in an Interval”

2019 ◽  
Vol 29 (1) ◽  
pp. 1-3
Author(s):  
Francesco Quaglia
Keyword(s):  
Computational Results ◽  
Random Integer

Eigenvalue Problem for the Second Order Differential Equation with Nonlocal

2006 ◽  
Vol 11 (1) ◽  
pp. 13-32 ◽  
Author(s):  
B. Bandyrskii ◽  
I. Lazurchak ◽  
V. Makarov ◽  
M. Sapagovas
Keyword(s):  
Differential Equation ◽  
Eigenvalue Problem ◽  
Variable Coefficient ◽  
Order Differential Equation ◽  
Integral Condition ◽  
Second Order ◽  
Computational Results ◽  
Discrete Method ◽  
Complex Eigenvalues ◽  
Nonlocal Integral Condition

The paper deals with numerical methods for eigenvalue problem for the second order ordinary differential operator with variable coefficient subject to nonlocal integral condition. FD-method (functional-discrete method) is derived and analyzed for calculating of eigenvalues, particulary complex eigenvalues. The convergence of FD-method is proved. Finally numerical procedures are suggested and computational results are schown.

Nickel(II)-Methyl Complexes Adopting Idealized Seesaw Geometries

2019 ◽  
Author(s):  
Ethan A. Hill ◽  
Norman Zhao ◽  
Alexander S. Filatov ◽  
John Anderson
Keyword(s):  
Singlet State ◽  
Strong Field ◽  
Structural Distortion ◽  
Computational Results ◽  
Threefold Symmetry ◽  
Chelating Ligand ◽  
Electronic Stabilization

We report four-coordinate nickel(II)-methyl complexes of tris-carbene borate ligands which adopt rare seesaw geometries. Experimental and computational results suggest the structural distortion from threefold symmetry results from a combination of electronic stabilization of the singlet state, strong field donors, and constrained angles from the chelating ligand.

Hybrid Imidazole-Pyridine Derivatives: An Approach to Novel Anticancer DNA Intercalators

2020 ◽  
Vol 27 (1) ◽  
pp. 154-169 ◽  
Author(s):  
Claudiu N. Lungu ◽  
Bogdan Ionel Bratanovici ◽  
Maria Mirabela Grigore ◽  
Vasilichia Antoci ◽  
Ionel I. Mangalagiu
Keyword(s):  
Experimental Data ◽  
Antimicrobial Properties ◽  
Qsar Model ◽  
Therapeutic Effectiveness ◽  
Computational Results ◽  
Pyridine Derivatives ◽  
Quadruplex Dna ◽  
Dna Intercalators ◽  
Structure Activity ◽  
G Quadruplex

Lack of specificity and subsequent therapeutic effectiveness of antimicrobial and antitumoral drugs is a common difficulty in therapy. The aim of this study is to investigate, both by experimental and computational methods, the antitumoral and antimicrobial properties of a series of synthesized imidazole-pyridine derivatives. Interaction with three targets was discussed: Dickerson-Drew dodecamer (PDB id 2ADU), G-quadruplex DNA string (PDB id 2F8U) and DNA strain in complex with dioxygenase (PDB id 3S5A). Docking energies were computed and represented graphically. On them, a QSAR model was developed in order to further investigate the structure-activity relationship. Results showed that synthesized compounds have antitumoral and antimicrobial properties. Computational results agreed with the experimental data.

EHAI: Enhanced Human Microbe-Disease Association Identification

2020 ◽  
Vol 21 (11) ◽  
pp. 1078-1084
Author(s):  
Ruizhi Fan ◽  
Chenhua Dong ◽  
Hu Song ◽  
Yixin Xu ◽  
Linsen Shi ◽  
...  
Keyword(s):  
Microbial Community ◽  
Human Health ◽  
Complex Diseases ◽  
Disease Association ◽  
Computational Results ◽  
Computational Approaches ◽  
Disease Diagnostics ◽  
Disease Associations ◽  
Association Discovery ◽  
Biological Tool

: Recently, an increasing number of biological and clinical reports have demonstrated that imbalance of microbial community has the ability to play important roles among several complex diseases concerning human health. Having a good knowledge of discovering potential of microbe-disease relationships, which provides the ability to having a better understanding of some issues, including disease pathology, further boosts disease diagnostics and prognostics, has been taken into account. Nevertheless, a few computational approaches can meet the need of huge scale of microbe-disease association discovery. In this work, we proposed the EHAI model, which is Enhanced Human microbe- disease Association Identification. EHAI employed the microbe-disease associations, and then Gaussian interaction profile kernel similarity has been utilized to enhance the basic microbe-disease association. Actually, some known microbe-disease associations and a large amount of associations are still unavailable among the datasets. The ‘super-microbe’ and ‘super-disease’ were employed to enhance the model. Computational results demonstrated that such super-classes have the ability to be helpful to the performance of EHAI. Therefore, it is anticipated that EHAI can be treated as an important biological tool in this field.

scholarly journals Discovering the maximum k-clique on social networks using bat optimization algorithm

2021 ◽  
Vol 8 (1) ◽  
Author(s):  
Akram Khodadadi ◽  
Shahram Saeidi
Keyword(s):  
Genetic Algorithm ◽  
Social Networks ◽  
Social Network ◽  
Coding Theory ◽  
Evaluation Criteria ◽  
Convergence Speed ◽  
Optimization Approach ◽  
Computational Results ◽  
Complete Subgraph ◽  
Np Complete

AbstractThe k-clique problem is identifying the largest complete subgraph of size k on a network, and it has many applications in Social Network Analysis (SNA), coding theory, geometry, etc. Due to the NP-Complete nature of the problem, the meta-heuristic approaches have raised the interest of the researchers and some algorithms are developed. In this paper, a new algorithm based on the Bat optimization approach is developed for finding the maximum k-clique on a social network to increase the convergence speed and evaluation criteria such as Precision, Recall, and F1-score. The proposed algorithm is simulated in Matlab® software over Dolphin social network and DIMACS dataset for k = 3, 4, 5. The computational results show that the convergence speed on the former dataset is increased in comparison with the Genetic Algorithm (GA) and Ant Colony Optimization (ACO) approaches. Besides, the evaluation criteria are also modified on the latter dataset and the F1-score is obtained as 100% for k = 5.

scholarly journals Reshuffle minimisation to improve storage yard operations efficiency

2021 ◽  
Vol 15 ◽  
pp. 174830262199401
Author(s):  
Hammed Bisira ◽  
Abdellah Salhi
Keyword(s):  
Integer Programming ◽  
Programming Model ◽  
Heuristic Approach ◽  
Container Terminals ◽  
Exact Method ◽  
Computational Results ◽  
Binary Integer Programming ◽  
Integer Programming Model ◽  
Compatibility Test ◽  
Storage Area

There are many ways to measure the efficiency of the storage area management in container terminals. These include minimising the need for container reshuffle especially at the yard level. In this paper, we consider the container reshuffle problem for stacking and retrieving containers. The problem was represented as a binary integer programming model and solved exactly. However, the exact method was not able to return results for large instances. We therefore considered a heuristic approach. A number of heuristics were implemented and compared on static and dynamic reshuffle problems including four new heuristics introduced here. Since heuristics are known to be instance dependent, we proposed a compatibility test to evaluate how well they work when combined to solve a reshuffle problem. Computational results of our methods on realistic instances are reported to be competitive and satisfactory.

scholarly journals Derivative-Free King’s Scheme for Multiple Zeros of Nonlinear Functions

Mathematics ◽  
2021 ◽  
Vol 9 (11) ◽  
pp. 1242
Author(s):  
Ramandeep Behl ◽  
Sonia Bhalla ◽  
Eulalia Martínez ◽  
Majed Aali Alsulami
Keyword(s):  
Iterative Methods ◽  
Fourth Order ◽  
Order Of Convergence ◽  
Real Life ◽  
Multiple Roots ◽  
Computational Results ◽  
Nonlinear Functions ◽  
First Order ◽  
Life Problems ◽  
Derivative Free

There is no doubt that the fourth-order King’s family is one of the important ones among its counterparts. However, it has two major problems: the first one is the calculation of the first-order derivative; secondly, it has a linear order of convergence in the case of multiple roots. In order to improve these complications, we suggested a new King’s family of iterative methods. The main features of our scheme are the optimal convergence order, being free from derivatives, and working for multiple roots (m≥2). In addition, we proposed a main theorem that illustrated the fourth order of convergence. It also satisfied the optimal Kung–Traub conjecture of iterative methods without memory. We compared our scheme with the latest iterative methods of the same order of convergence on several real-life problems. In accordance with the computational results, we concluded that our method showed superior behavior compared to the existing methods.

scholarly journals Finding Global Minima with a Filled Function Approach for Non-Smooth Global Optimization

2010 ◽  
Vol 2010 ◽  
pp. 1-10 ◽  
Author(s):  
Weixiang Wang ◽  
Youlin Shang ◽  
Ying Zhang
Keyword(s):  
Global Optimization ◽  
Optimization Problem ◽  
Numerical Test ◽  
Function Approach ◽  
Global Optimization Problem ◽  
Computational Results ◽  
Filled Function ◽  
Global Minima ◽  
Smooth Case ◽  
Definition Of

A filled function approach is proposed for solving a non-smooth unconstrained global optimization problem. First, the definition of filled function in Zhang (2009) for smooth global optimization is extended to non-smooth case and a new one is put forwarded. Then, a novel filled function is proposed for non-smooth the global optimization and a corresponding non-smooth algorithm based on the filled function is designed. At last, a numerical test is made. The computational results demonstrate that the proposed approach is effcient and reliable.

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