Bulk RNA-seq analysis of imatinib response in K562 CML cells using nf-core/rnaseq on GCP, with DESeq2, PROGENy, and fgsea downstream analysis
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Updated
May 1, 2026 - Python
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kinase-inhibitor
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Structural bioinformatics analysis of EGFR-Gefitinib interactions using BioPython.
python bioinformatics structural-biology protein-structure computational-biology biopython drug-discovery egfr cancer-biology protein-ligand-interaction gefitinib kinase-inhibitor
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Jun 9, 2026 - Jupyter Notebook
Two-stage virtual screening + 100 ns MD identifying nilotinib and alectinib as complementary BRAF V600E repurposing candidates for Langerhans cell histiocytosis
reproducible-research molecular-dynamics computational-biology openmm computational-chemistry drug-repurposing amber virtual-screening lch mmpbsa autodock-vina braf mm-gbsa braf-v600e langerhans-cell-histiocytosis kinase-inhibitor nilotinib alectinib
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Apr 12, 2026 - Python
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