Computational insights into molecular docking strategies for non-small cell lung cancer drug discovery

R Das - 2024 - dspace.bracu.ac.bd
This work addresses computational approaches to non-small cell lung cancer (NSCLC) drug
discovery, highlighting the vital part that molecular docking plays in the early stages of drug …

Improving Gradient Boosting Machine for Modelling High Throughput Screening Data in Drug Discovery

D Boldini - 2024 - mediatum.ub.tum.de
This thesis investigates modeling High Throughput Screening datasets in drug discovery via
Gradient Boosting Machines for the efficient identification of bioactive molecules. New …

MAKALUVAMINES AS CHITINASE INHIBITORS ISOLATED FROM AN ASCIDIAN OF THE GREAT BARRIER REEF

JL Haworth - 2024 - clok.uclan.ac.uk
This thesis investigates the secondary metabolites isolated from a marine tunicate species of
the Great Barrier Reef, Australia. Structural elucidation techniques led to the identification of …