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In silico Drug Repurposing of Anticancer Drug 5-FU and Analogues Against SARS-CoV-2 Main Protease: Molecular Docking, Molecular Dynamics Simulation, Pharmacokinetics and Chemical Reactivity Studies
Published in Advances and Applications in Bioinformatics and Chemistry (2022)Get full text
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Simulation and Lyapunov's Exponents Characterisation of Lorenz and Rosler Dynamics
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Simulating the Dynamics and Influences of the West African Westerly Jet
Published 2023“…While past studies have examined the dynamics of the WAWJ and its influences on Sahelian rainfall, there is no information on how well the jet is simulated by contemporary climate models. …”
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Simulation and testing of centrifugal pump cavitation
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Simulating nitrogen dynamics in sugarcane cropping systems using DSSAT-Canegro
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Optimizing dynamic locomotion in Baleka II: from simulation to real-world running
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A computer simulation of the population dynamics of the Cape hakes (Merluccius capensis and M. paradoxus)
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The numerical simulation of thin-walled shells when subjected to a dynamic axial load
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Formation and dynamics of defects in pure and ion implanted a-titanium studied by quantum simulations
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A system dynamics simulation for strategic inventory management in the South African automotive industry
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A Non-linear Visco-elastic Model for Dynamic Finite Element Simulation of Bovine Cortical Bone
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Urban Dynamics and Vulnerability to Disasters in Lagos State, Nigeria (1982 – 2012)
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Investigating intervention strategies for the management of diabetes in South Africa: A system dynamics approach
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Atomistic Simulation of Na+ and Cl- Ions Binding Mechanisms to Tobermorite 14Å as a Model for Alkali Activated Cements
Published 2022“…Second, introducing the 5% Na+ ions led to slower dynamics for all species in this system. …”
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A Technical and economic assessment of molten salt parabolic trough power plants and operating strategies in Southern Africa.
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A dynamic flotation model for real-time control and optimisation
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