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The strengths of hydrophobic contacts, π-π interactions, and cation-π interactions are based on knowledge-based potentials [33] in which each individual interaction has a score between 0 and 1.
With a few exceptions, multi-threaded operation is not usually required for desktop-based visual analytics applications since all interactions are based on single mouse input.
Additive interactions are based on either similar or dissimilar non-interactive effects of chemicals.
The interactions are based on co-occurrence of two entities in relevant PubMed literature.
The interactions are based on co-occurrence of two entities in the relevant PubMed records.
The computational tools intended for quantitative assessment of protein-ligand interactions are based on several factors including protein-ligand docking, molecular dynamic simulation and free energy calculations [1].
Similar(29)
Evaluation of the interactions was based on minimum and maximum scenarios.
Our algorithm for predicting new drug protein interactions is based on all simple paths of particular lengths on such a graph model.
Another convenient classification of weak electrostatic interactions is based on the electronic energy densities, introduced by Espinosa et al. [35], who extended the idea by Cremer and Kraka.
The calculation of diffusivities as a function of temperature and intracrystalline concentration taking into account sorbate/sorbate interactions is based on the Monte Carlo method.
Description of the interactions is based on the extension of the mean molecular field by a contribution due to a short-range correlation effect.
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