Highly potent dipeptidyl peptidase 8/9 (DPP8/9) inhibitors designed via relative binding free energy calculations
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European journal of medicinal chemistry - ISSN 0223-5234-297 (2025) p. 1-12
Allosteric inhibition of trypanosomatid pyruvate kinases by a camelid single-domain antibody
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eLife - ISSN 2050-084X-13 (2025) p. 1-27
A beginner’s approach to deep learning applied to VS and MD techniques
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Journal of Cheminformatics - ISSN 1758-2946-17:1 (2025) p. 1-44
Allosteric inhibition of trypanosomatid pyruvate kinases by a camelid single-domain antibody
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eLife - ISSN 2050-084X-13 (2025) p. 1-27
Oxazole-based ferroptosis inhibitors with promising properties to treat central nervous system diseases
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Journal of medicinal chemistry - ISSN 0022-2623-68:4 (2025) p. 4908-4928