Two decades of Martini: Better beads, broader scope
The Martini model, a coarse‐grained force field for molecular dynamics simulations, has
been around for nearly two decades. Originally developed for lipid‐based systems by the …
been around for nearly two decades. Originally developed for lipid‐based systems by the …
Computational modeling for the design and development of nano based drug delivery systems
The nanoparticle delivery system is one of the promising nanotechnology applications for
efficient drug delivery to the targeted site. However, the selection of lead excipient …
efficient drug delivery to the targeted site. However, the selection of lead excipient …
[HTML][HTML] Dendrimer-based nanocomposites for the production of RNA delivery systems
CC Lim, LY Chia, PV Kumar - OpenNano, 2023 - Elsevier
A novel approach to treating cancer has been revealed to be effective cancer vaccination. It
has also been demonstrated that nucleic acid therapies such as mRNA and siRNA are very …
has also been demonstrated that nucleic acid therapies such as mRNA and siRNA are very …
Computer Aided Development of Nucleic Acid Applications in Nanotechnologies
Utilization of nucleic acids (NAs) in nanotechnologies and nanotechnology‐related
applications is a growing field with broad application potential, ranging from biosensing up …
applications is a growing field with broad application potential, ranging from biosensing up …
In silico study of PEI-PEG-squalene-dsDNA polyplex formation: The delicate role of the PEG length in the binding of PEI to DNA
Biocompatible hydrophilic polyethylene glycol (PEG) is widely used in biomedical
applications, such as drug or gene delivery, tissue engineering or as an antifouling …
applications, such as drug or gene delivery, tissue engineering or as an antifouling …
High Charge Density in Peptide Dendrimers is Required to Destabilize Membranes: Insights into Endosome Evasion
FEP Rodrigues, T Darbre… - Journal of chemical …, 2024 - ACS Publications
Peptide dendrimers are a type of branched, symmetric, and topologically well-defined
molecule that have already been used as delivery systems for nucleic acid transfection …
molecule that have already been used as delivery systems for nucleic acid transfection …
A Molecular Dynamics Simulation of Complexes of Fullerenes and Lysine-Based Peptide Dendrimers with and without Glycine Spacers
VV Bezrodnyi, SE Mikhtaniuk, OV Shavykin… - International Journal of …, 2024 - mdpi.com
The development of new nanocontainers for hydrophobic drugs is one of the most important
tasks of drug delivery. Dendrimers with hydrophobic interiors and soluble terminal groups …
tasks of drug delivery. Dendrimers with hydrophobic interiors and soluble terminal groups …
Core-size and geometry versus toxicity in small amino terminated PAMAM dendrimers
CB Hansen, A Janaszewska, M Dąbrzalska… - RSC …, 2024 - pubs.rsc.org
A series of 6 small PAMAM dendrimers (G0-dendrimers) differing in the size, polarity and
flexibility has been synthesized. The toxicity has been investigated in three different human …
flexibility has been synthesized. The toxicity has been investigated in three different human …
Mathematical and computational models of RNA nanoclusters and their applications in data-driven environments
Ribonucleic acid (RNA) is a fundamental molecule having several favourable structural
properties that can be used for various potential applications in the field of nanotechnology …
properties that can be used for various potential applications in the field of nanotechnology …
Characterization of the Interaction of Polymeric Micelles with siRNA: A Combined Experimental and Molecular Dynamics Study
The simulation of large molecular systems remains a daunting challenge, which justifies the
exploration of novel methodologies to keep computers as an ideal companion tool for …
exploration of novel methodologies to keep computers as an ideal companion tool for …