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AlzyFinder: A Machine-Learning-Driven Platform for Ligand-Based Virtual Screening and Network Pharmacology
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Network pharmacology approaches for research of Traditional Chinese Medicines
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Computational approaches in drug discovery and design
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Dynamic light scattering: a practical guide and applications in biomedical sciences
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Raman spectroscopy to study biomolecules, their structure, and dynamics
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Perspectives on Nuclear Magnetic Resonance Spectroscopy in Drug Discovery Research
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X-Ray Crystallography in Drug Discovery
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Characterizing aripiprazole and its ester derivatives, lauroxil and cavoxil, in interaction with dopamine D2 receptor: Molecular docking and dynamics simulations with physicochemical appraisals
11天前
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Pharmacophore modelling and molecular dynamics simulation to identify novel molecules targeting catechol-O-methyltransferase and dopamine D3 receptor to combat Parkinson’s disease
11天前
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Two Binding Geometries for Risperidone in Dopamine D3 Receptors: Insights on the Fast-Off Mechanism through Docking, Quantum Biochemistry, and Molecular Dynamics Simulations
11天前
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