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MaxEnt Modeling of Future Habitat Shifts of <i>Itea yunnanensis</i> in China Under Climate Change Scenarios
Published 2025-07-01Get full text
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Ship local path planning method based on three-dimensional potential field model
Published 2025-02-01Get full text
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A Machine Learning Free Energy Functional for the 1D Reference Interaction Site Model: Towards Prediction of Solvation Free Energy for All Solvent Systems
Published 2024-11-01“…Solvation free energy (SFE) is an important thermodynamic property in characterising molecular solvation and so accurate prediction of this property is sought after. The One-Dimensional Reference Interaction Site Model (RISM) is a well-established method for modelling solvation, but it is known to yield large errors in the calculation of SFE. …”
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