The authors use molecular modeling to test analogs of the stearoyl-coenzyme A desaturase 1 (SCD1) inhibitor MF-438 with implications for future development of Parkinson's disease therapeutics.
Read More...Modeling stearoyl-coenzyme A desaturase 1 inhibitors to ameliorate α-Syn cytotoxicity in Parkinson's disease
The authors use molecular modeling to test analogs of the stearoyl-coenzyme A desaturase 1 (SCD1) inhibitor MF-438 with implications for future development of Parkinson's disease therapeutics.
Read More...Modeling the heart’s reaction to narrow blood vessels
Cardiovascular diseases are the largest cause of death globally, making it a critical area of focus. The circulatory system is required to make the heart function. One component of this system is blood vessels, which is the focus of our study. Our work aims to demonstrate the numeric relationship between a blood vessel's diameter and the number of pumps needed to transport blood.
Read More...Modelling effects of alkylamines on sea salt aerosols using the Extended Aerosols and Inorganics Model
With monitoring of climate change and the evolving properties of the atmosphere more critical than ever, the authors of this study take sea salt aerosols into consideration. These sea salt aerosols, sourced from the bubbles found at the surface of the sea, serve as cloud condensation nuclei (CCN) and are effective for the formation of clouds, light scattering in the atmosphere, and cooling of the climate. With amines being involved in the process of CCN formation, the authors explore the effects of alkylamines on the properties of sea salt aerosols and their potential relevance to climate change.
Read More...Modeling Energy Produced by Solar Panels
In this study, the authors test the effect that the tilt angle of a solar panel has on the amount of energy it generates. This investigation highlights a simple way that people can harvest renewable energy more efficiently and effectively.
Read More...A model for angle evolution in conical piles formed using the fixed funnel method
When granular materials are poured onto a surface, they form conical piles whose slopes increase before reaching a stable angle of repose. We found that this angle evolution follows a previously unrecognized two-phase exponential growth pattern that is conserved across granular materials with diverse particle properties. The parameters of this model correlate with particle friction and are influenced by deposition conditions, providing a quantitative framework for describing pile formation.
Read More...Predictive modeling of cardiovascular disease using exercise-based electrocardiography
The authors looked factors that could lead to earlier diagnosis of cardiovascular disease thereby improving patient outcomes. They found that advances in imaging and electrocardiography contribute to earlier detection of cardiovascular disease.
Read More...The impact of greenhouse gases, regions, and sectors on future temperature anomaly with the FaIR model
This study explores how different economic sectors, geographic regions, and greenhouse gas types might affect future global mean surface temperature (GMST) anomalies differently from historical patterns. Using the Finite Amplitude Impulse Response (FaIR) model and four Shared Socioeconomic Pathways (SSPs) — SSP126, SSP245, SSP370, and SSP585 — the research reveals that future contributions to GMST anomalies.
Read More...Homology modeling of clinically-relevant rilpivirine-resistant HIV-RT variants identifies novel rilpivirine analogs with retained binding affinity against NNRTI-resistant HIV mutations
Human immunodeficiency virus (HIV), which affects tens of millions of individuals worldwide, can lead to acquired immunodeficiency syndrome (AIDS). While there is currently no cure for HIV, the development of small molecule antiretroviral agents has greatly improved the prognosis of infected individuals, especially in developed countries. Here, the authors employ homology modeling and molecular docking towards the identification of novel rilpivirine analogs that retain high binding affinity to clinically relevant rilpivirine-resistant mutations of the HIV reverse transcriptase enzyme.
Read More...Drosophila melanogaster: A model to observe behavioral effects of mutated Foxp
The authors looked at the effects of different treatments using flies with neurodevelopmental disorders.
Read More...Building an affordable model wave energy converter using a magnet and a coil
Here, seeking to identify a method to locally produce and capture renewable energy in Hawai'i and other island communities, the authors built and tested a small-scale model wave energy converter. They tested various configurations of a floated magnet surrounded by a wire coal, where the motion of the magnet due to a wave results in induction current in the coil. While they identified methods to increase the voltage and current generated, they also found that corrosion results in significant deterioration.
Read More...