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PubMed COVID-19 Clinical Care

2141 - 2150 of 3242 results found

Solvated interaction energy: from small-molecule to antibody drug design

Date
Friday, June 23, 2023 - 4:00 AM
Description
Scoring functions are ubiquitous in structure-based drug design as an aid to predicting binding modes and estimating binding affinities. Ideally, a scoring function should be broadly applicable, obviating the need to recalibrate and refit its