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Recent applications of computational methods to allosteric drug discovery.
Govindaraj RG, Thangapandian S, Schauperl M, Denny RA, Diller DJ. Govindaraj RG, et al. Among authors: thangapandian s. Front Mol Biosci. 2023 Jan 12;9:1070328. doi: 10.3389/fmolb.2022.1070328. eCollection 2022. Front Mol Biosci. 2023. PMID: 36710877 Free PMC article. Review.
Probing cholesterol binding and translocation in P-glycoprotein.
Thangapandian S, Kapoor K, Tajkhorshid E. Thangapandian S, et al. Biochim Biophys Acta Biomembr. 2020 Jan 1;1862(1):183090. doi: 10.1016/j.bbamem.2019.183090. Epub 2019 Oct 30. Biochim Biophys Acta Biomembr. 2020. PMID: 31676371 Free PMC article.
Deep Learning-Based Structure-Activity Relationship Modeling for Multi-Category Toxicity Classification: A Case Study of 10K Tox21 Chemicals With High-Throughput Cell-Based Androgen Receptor Bioassay Data.
Idakwo G, Thangapandian S, Luttrell J 4th, Zhou Z, Zhang C, Gong P. Idakwo G, et al. Among authors: thangapandian s. Front Physiol. 2019 Aug 13;10:1044. doi: 10.3389/fphys.2019.01044. eCollection 2019. Front Physiol. 2019. PMID: 31456700 Free PMC article.
48 results