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Year | Number of Results |
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2022 | 2 |
2023 | 3 |
2024 | 0 |
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Page 1
A comprehensive study of SARS-CoV-2 main protease (Mpro) inhibitor-resistant mutants selected in a VSV-based system.
bioRxiv [Preprint]. 2023 Oct 4:2023.09.22.558628. doi: 10.1101/2023.09.22.558628.
bioRxiv. 2023.
PMID: 37808638
Free PMC article.
Preprint.
Qualitative Estimation of Protein-Ligand Complex Stability through Thermal Titration Molecular Dynamics Simulations.
Pavan M, Menin S, Bassani D, Sturlese M, Moro S.
Pavan M, et al. Among authors: menin s.
J Chem Inf Model. 2022 Nov 28;62(22):5715-5728. doi: 10.1021/acs.jcim.2c00995. Epub 2022 Oct 31.
J Chem Inf Model. 2022.
PMID: 36315402
Free PMC article.
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Thermal Titration Molecular Dynamics (TTMD): Not Your Usual Post-Docking Refinement.
Menin S, Pavan M, Salmaso V, Sturlese M, Moro S.
Menin S, et al.
Int J Mol Sci. 2023 Feb 10;24(4):3596. doi: 10.3390/ijms24043596.
Int J Mol Sci. 2023.
PMID: 36835004
Free PMC article.
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Thermal titration molecular dynamics (TTMD): shedding light on the stability of RNA-small molecule complexes.
Dodaro A, Pavan M, Menin S, Salmaso V, Sturlese M, Moro S.
Dodaro A, et al. Among authors: menin s.
Front Mol Biosci. 2023 Nov 13;10:1294543. doi: 10.3389/fmolb.2023.1294543. eCollection 2023.
Front Mol Biosci. 2023.
PMID: 38028536
Free PMC article.
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Implementing a Scoring Function Based on Interaction Fingerprint for Autogrow4: Protein Kinase CK1δ as a Case Study.
Pavan M, Menin S, Bassani D, Sturlese M, Moro S.
Pavan M, et al. Among authors: menin s.
Front Mol Biosci. 2022 Jul 7;9:909499. doi: 10.3389/fmolb.2022.909499. eCollection 2022.
Front Mol Biosci. 2022.
PMID: 35874609
Free PMC article.
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