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Table representation of search results timeline featuring number of search results per year.
Year | Number of Results |
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2020 | 1 |
2021 | 4 |
2022 | 1 |
2023 | 1 |
2024 | 0 |
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7 results
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Page 1
Reconstruction of lossless molecular representations from fingerprints.
J Cheminform. 2023 Feb 23;15(1):26. doi: 10.1186/s13321-023-00693-0.
J Cheminform. 2023.
PMID: 36823647
Free PMC article.
A-Prot: protein structure modeling using MSA transformer.
Hong Y, Lee J, Ko J.
Hong Y, et al.
BMC Bioinformatics. 2022 Mar 16;23(1):93. doi: 10.1186/s12859-022-04628-8.
BMC Bioinformatics. 2022.
PMID: 35296230
Free PMC article.
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Identifying the Hot Spot Residues of the SARS-CoV-2 Main Protease Using MM-PBSA and Multiple Force Fields.
Byun J, Lee J.
Byun J, et al.
Life (Basel). 2021 Dec 31;12(1):54. doi: 10.3390/life12010054.
Life (Basel). 2021.
PMID: 35054447
Free PMC article.
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V-Dock: Fast Generation of Novel Drug-like Molecules Using Machine-Learning-Based Docking Score and Molecular Optimization.
Choi J, Lee J.
Choi J, et al.
Int J Mol Sci. 2021 Oct 27;22(21):11635. doi: 10.3390/ijms222111635.
Int J Mol Sci. 2021.
PMID: 34769065
Free PMC article.
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Modeling SARS-CoV-2 proteins in the CASP-commons experiment.
Kryshtafovych A, Moult J, Billings WM, Della Corte D, Fidelis K, Kwon S, Olechnovič K, Seok C, Venclovas Č, Won J; CASP-COVID participants.
Kryshtafovych A, et al.
Proteins. 2021 Dec;89(12):1987-1996. doi: 10.1002/prot.26231. Epub 2021 Oct 5.
Proteins. 2021.
PMID: 34462960
Free PMC article.
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MolFinder: an evolutionary algorithm for the global optimization of molecular properties and the extensive exploration of chemical space using SMILES.
Kwon Y, Lee J.
Kwon Y, et al.
J Cheminform. 2021 Mar 18;13(1):24. doi: 10.1186/s13321-021-00501-7.
J Cheminform. 2021.
PMID: 33736687
Free PMC article.
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AK-Score: Accurate Protein-Ligand Binding Affinity Prediction Using an Ensemble of 3D-Convolutional Neural Networks.
Kwon Y, Shin WH, Ko J, Lee J.
Kwon Y, et al.
Int J Mol Sci. 2020 Nov 10;21(22):8424. doi: 10.3390/ijms21228424.
Int J Mol Sci. 2020.
PMID: 33182567
Free PMC article.
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