Skip to content
<title>Channels - Elucidation of Molecular Interactions Between Drug–Polymer in Amorphous Solid Dispersion by a Computational Approach Using Molecular Dynamics Simulations :: FRELIP Discovery
Channels Elucidation of Molecular Interactions Between Drug–Polymer in Amorphous Solid Dispersion by a Computational Approach Using Molecular Dynamics Simulations
In silico Drug Repurposing of Anticancer Drug 5-FU and Analogues Against SARS-CoV-2 Main Protease: Molecular Docking, Molecular Dynamics Simulation, Pharmacokinetics and Chemical Reactivity Studies
Binding Analysis Using Accelerated Molecular Dynamics Simulations and Future Perspectives
Enzymatic degradation of biopolymers in amorphous and molten states: mechanisms and applications
In silico Study of Antiviral Activity of Polyphenol Compounds from Ocimum basilicum by Molecular Docking, ADMET, and Drug-Likeness Analysis
Computational Methods for Ab Initio Molecular Dynamics
Toward Understanding the Anticancer Activity of the Phytocompounds from Eugenia uniflora Using Molecular Docking, in silico Toxicity and Dynamics Studies
YIPFα1A expression is regulated by multilayered molecular mechanisms
Antibacterial and Antioxidant Activities, in silico Molecular Docking, ADMET and DFT Analysis of Compounds from Roots of Cyphostemma cyphopetalum
Evaluation of botanical extracts and molecular docking approaches for sustainable management of rice blast disease in Mushk Budji rice
Molecular epidemiology and multi-scale drivers of piscine myocarditis virus dispersal in salmon aquaculture
Antimicrobial Activity, in silico Molecular Docking, ADMET and DFT Analysis of Secondary Metabolites from Roots of Three Ethiopian Medicinal Plants
Synthesis, Biological Evaluation and Molecular Docking Studies of Novel Series of Bis-1,2,4-Triazoles as Thymidine Phosphorylase Inhibitor
In silico Molecular Docking Approach to Identify Potential Antihypertensive Compounds from Ajuga integrifolia Buch.-Ham. Ex D. Don (Armagusa)
Targeting EGFR (PDB id-1XKK) for Immunomodulation: Network Pharmacology and Molecular Docking Insights into Glycyrrhiza glabra, Piper longum, and Phyllanthus emblica
In Silico Molecular Docking of Marine Drugs Against Cancer Proteins
Understanding bio‐based polymers: A study of origins, properties, biodegradation and their impact on health and the environment
Epigenetic modifications in cancer drug resistance: molecular mechanisms and therapeutic interventions
Molecular phylogenetics and trait‐dependent biogeography offer insights on the dispersal of Meiogyne (Annonaceae) across the Australasia–Pacific region
Molecular Structures and Molecular Interactions of Peptides and Proteins at Buried Interfaces Studied Using Sum Frequency Generation Vibrational Spectroscopy
Medicated Kajal Ophthalmic Nanoparticulated Drug Delivery System
Molecular aspects of SGLT2 inhibitor interactions in myocardial failure
Molecular Dynamics Investigation of Interfacial Interactions and Wettability in Coal–SiO2–Water Three-Phase Systems
Network Pharmacology of Natural Polyphenols for Stroke: A Bioinformatic Approach to Drug Design
Digital twins to accelerate target identification and drug development for immune‐mediated disorders
