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Real-World Applications and Experiences of AI/ML Deployment for Drug Discovery.
J Med Chem. 2025 Jan 8. doi: 10.1021/acs.jmedchem.4c03044. Online ahead of print.
J Med Chem. 2025.
PMID: 39772505
No abstract available.
Automated Lead Optimization of MMP-12 Inhibitors Using a Genetic Algorithm.
Pickett SD, Green DV, Hunt DL, Pardoe DA, Hughes I.
Pickett SD, et al. Among authors: pardoe da.
ACS Med Chem Lett. 2010 Oct 20;2(1):28-33. doi: 10.1021/ml100191f. eCollection 2011 Jan 13.
ACS Med Chem Lett. 2010.
PMID: 24900251
Free PMC article.
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Controlling diastereoselectivity in the reactions of enantiomerically pure alpha-bromoacyl-imidazolidinones with nitrogen nucleophiles: substitution reactions with retention or inversion of configuration.
Treweeke NR, Hitchcock PB, Pardoe DA, Caddick S.
Treweeke NR, et al. Among authors: pardoe da.
Chem Commun (Camb). 2005 Apr 14;(14):1868-70. doi: 10.1039/b417954d. Epub 2005 Feb 8.
Chem Commun (Camb). 2005.
PMID: 15795770
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Scaling basic toxicokinetic parameters from rat to man.
Bachmann K, Pardoe D, White D.
Bachmann K, et al. Among authors: pardoe d.
Environ Health Perspect. 1996 Apr;104(4):400-7. doi: 10.1289/ehp.96104400.
Environ Health Perspect. 1996.
PMID: 8732950
Free PMC article.
Review.
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