In silico molecular docking and dynamic simulation of anti-cholinesterase compounds from the extract of Catunaregam spinosa for possible treatment of Alzheimer's disease
Open Access
Abstract
No abstract availableKeywords
This publication has 49 references indexed in Scilit:
- CHARMM-GUIMembrane Buildertoward realistic biological membrane simulationsJournal of Computational Chemistry, 2014
- Optimization of ultrasonic-assisted extraction of bioactive alkaloid compounds from rhizoma coptidis (Coptis chinensis Franch.) using response surface methodologyFood Chemistry, 2014
- Tacrine-based dual binding site acetylcholinesterase inhibitors as potential disease-modifying anti-Alzheimer drug candidatesChemico-Biological Interactions, 2010
- Docking Ligands into Flexible and Solvated Macromolecules. 5. Force-Field-Based Prediction of Binding Affinities of Ligands to ProteinsJournal of Chemical Information and Modeling, 2009
- CHARMM-GUI Membrane Builder for Mixed Bilayers and Its Application to Yeast MembranesBiophysical Journal, 2009
- The Protein Data Bank (PDB), Its Related Services and Software Tools as Key Components for In Silico Guided Drug DiscoveryJournal of Medicinal Chemistry, 2008
- Ranking Targets in Structure-Based Virtual Screening of Three-Dimensional Protein Libraries: Methods and ProblemsJournal of Chemical Information and Modeling, 2008
- ProMate: A Structure Based Prediction Program to Identify the Location of Protein–Protein Binding SitesJournal of Molecular Biology, 2004
- Alzheimer's disease: the pharmacological pathwayFundamental & Clinical Pharmacology, 2003
- Acetylcholinesterase inhibitory activity of some Amaryllidaceae alkaloids and Narcissus extractsLife Sciences, 2002