Ontology highlight
ABSTRACT:
SUBMITTER: K R J
PROVIDER: S-EPMC6044099 | biostudies-literature | 2018 Jul
REPOSITORIES: biostudies-literature
K R Jinuraj J M Rakhila R M Dhanalakshmi D R Sajeev S Gad Akshata A K Jayan J P Muhammed Iqbal MI Manuel Andrew Titus AT U C Abdul Jaleel AJ
BMC research notes 20180713 1
<h4>Objectives</h4>The primary goal of this experiment is to prioritize molecular descriptors that control the activity of active molecules that could reduce the dimensionality produced during the virtual screening process. It also aims to: (1) develop a methodology for sampling large datasets and the statistical verification of the sampling process, (2) apply screening filter to detect molecules with polypharmacological or promiscuous activity.<h4>Results</h4>Sampling from large a dataset and i ...[more]