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Titlebook: Computational Science and Its Applications – ICCSA 2022 Workshops; Malaga, Spain, July Osvaldo Gervasi,Beniamino Murgante,Chiara Garau Con

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Virtual Screening Based on Electrostatic Similarity and Flexible Ligandsplying computational procedures to prefilter databases to a subset of potential compounds, to be characterized experimentally in later phases..The problem lies in the fact that the current VS methods make simplifications, meaning they are not exhaustive. One particular common simplification is to co
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Solving a Capacitated Waste Collection Problem Using an Open-Source Tool waste properly. Waste collection and transport is the first task, traditionally carried out by countries/municipalities responsible for waste management. In this approach, drivers are responsible for decision-making regarding collection routes, leading to inefficient resource expenses. In this sens
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Analyzing the MathE Platform Through Clustering Algorithmsational environment. The MathE platform was created with the main goal of providing students and teachers with a new perspective on mathematical teaching and learning in a dynamic and appealing way, relying on digital interactive technologies that enable customized study. The MathE platform has been
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A Tabu Search with a Double Neighborhood Strategyduce very good solutions, optimal or close to optimal for some hard combinatorial optimization problems. The drawback is that we have in general no optimality certificate, but this is the price to be paid for problems where the exact methods are too costly in terms of time and computational memory.
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The S,(,S)+SiH,(,A,) Reaction: Toward the Synthesis of Interstellar SiSlleged to be precursors of interstellar silicon sulfide, SiS. Electronic structure calculations allowed us to characterize the relevant features of the potential energy surface of the system and identify the reaction pathways. The reaction has two exothermic channels leading to the isomeric species
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Conference proceedings 2022 mitigation based on the Resilience (ASTER 2022); Advances in Web Based Learning (AWBL 2022); Blockchain and Distributed Ledgers: Technologies and Applications (BDLTA 2022); Bio and Neuro inspired Computing and Applications (BIONCA 2022); Configurational Analysis For Cities (CA Cities 2022); Computa
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Sustainability of Japan’s Transport Sectoraluates the dynamic change in the sustainable performance through the biennial Malmquist index. Main results indicate that the total productivity change has been improved mainly due to the progression of the frontier that has been observed for all countries from 2018. However, an increasing number o
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