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Assessing How Residual Errors of Scoring Functions Correlate to Ligand Structural Features.
Int J Mol Sci. 2022 Nov 30;23(23):15018. doi: 10.3390/ijms232315018.
Int J Mol Sci. 2022.
PMID: 36499344
Free PMC article.
In Silico Structure-Based Approach for Group Efficiency Estimation in Fragment-Based Drug Design Using Evaluation of Fragment Contributions.
Shulga DA, Ivanov NN, Palyulin VA.
Shulga DA, et al. Among authors: ivanov nn.
Molecules. 2022 Mar 18;27(6):1985. doi: 10.3390/molecules27061985.
Molecules. 2022.
PMID: 35335347
Free PMC article.
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