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Chelator-Based Parameterization of the 12-6-4 Lennard-Jones Molecular Mechanics Potential for More Realistic Metal Ion-Protein Interactions.
J Chem Theory Comput. 2022 Apr 12;18(4):2367-2374. doi: 10.1021/acs.jctc.1c00898. Epub 2022 Mar 23.
J Chem Theory Comput. 2022.
PMID: 35319190
Free PMC article.
DNA-DAPI Interaction-Based Method for Cell Proliferation Rate Evaluation in 3D Structures.
Šimoliūnas E, Kantakevičius P, Kalvaitytė M, Bagdzevičiūtė L, Alksnė M, Baltriukienė D.
Šimoliūnas E, et al. Among authors: kantakevicius p.
Curr Issues Mol Biol. 2021 May 30;43(1):251-263. doi: 10.3390/cimb43010021.
Curr Issues Mol Biol. 2021.
PMID: 34070775
Free PMC article.
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