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Sun & Rain Works

Est. 2005 · Eugene, OR

virtual screening — MetaHistoryBook

virtual screening

academic discipline in cheminformatics

Wikipedia ↗Wikidata (Q4112105) ↗

Details

Instance of: Q11862829
Subclass of: Q910164

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Subject of

Virtual screening and in silico design of novel inhibitors of bacterial lectins.
Integrating logic-based machine learning and virtual screening to discover new drugs.
Virtual screening for plant PARP inhibitors – what can be learned from human PARP inhibitors?
In silico identification of novel PKC βII inhibitors: ligand and receptor based pharmacophore modeling, virtual screening, and molecular dynamics study.
Probing the impact of protein and ligand preparation procedures on chemotype enrichment in structure-based virtual screening using DEKOIS 2.0 benchmark sets.
Identification of SUMO activating enzyme 1 inhibitors utilizing virtual screening approach.
3D pharmacophore alignments: does improved geometric accuracy affect virtual screening performance?
Kernel learning for ligand-based virtual screening: discovery of a new PPARγ agonist.
Visualization and virtual screening in molecular property spaces.
Docking and virtual screening of novel inhibitors for mono-ADP-ribosylating toxins.

Virtual screening workflow for glycogen synthase kinase 3β inhibitors: convergence of ligand-based and structure-based approaches.

A framework and workflow system for virtual screening and molecular docking