Proposes a new exponential-logarithmic descriptor (ELD) for drug-receptor interactions that integrates thermodynamic and probabilistic aspects and exhibits broader dynamic range in numerical simulations.
Synthesis, Molecular Docking, and Binding Gibbs Free Energy Calculation of β-Nitrostyrene Derivatives: Potential Inhibitors of SARS-CoV-2 3CL Protease
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An exponential logarithmic measure of drug receptor binding and saturation
Proposes a new exponential-logarithmic descriptor (ELD) for drug-receptor interactions that integrates thermodynamic and probabilistic aspects and exhibits broader dynamic range in numerical simulations.