Lifeboat Foundation

A team of scientists at Freie Universität Berlin has developed an artificial intelligence (AI) method for calculating the ground state of the Schrödinger equation in quantum chemistry. The goal of quantum chemistry is to predict chemical and physical properties of molecules based solely on the arrangement of their atoms in space, avoiding the need for resource-intensive and time-consuming laboratory experiments. In principle, this can be achieved by solving the Schrödinger equation, but in practice this is extremely difficult.

Up to now, it has been impossible to find an exact solution for arbitrary molecules that can be efficiently computed. But the team at Freie Universität has developed a deep learning method that can achieve an unprecedented combination of accuracy and computational efficiency. AI has transformed many technological and scientific areas, from computer vision to materials science. “We believe that our approach may significantly impact the future of quantum chemistry,” says Professor Frank Noé, who led the team effort. The results were published in the reputed journal Nature Chemistry.

Central to both quantum chemistry and the Schrödinger equation is the wave function —a mathematical object that completely specifies the behavior of the electrons in a molecule. The wave function is a high-dimensional entity, and it is therefore extremely difficult to capture all the nuances that encode how the individual electrons affect each other. Many methods of quantum chemistry in fact give up on expressing the wave function altogether, instead attempting only to determine the energy of a given molecule. This however requires approximations to be made, limiting the prediction quality of such methods.

Hydrogen is a sustainable source of clean energy that avoids toxic emissions and can add value to multiple sectors in the economy including transportation, power generation, metals manufacturing, among others. Technologies for storing and transporting hydrogen bridge the gap between sustainable energy production and fuel use, and therefore are an essential component of a viable hydrogen economy. But traditional means of storage and transportation are expensive and susceptible to contamination. As a result, researchers are searching for alternative techniques that are reliable, low-cost and simple. More-efficient hydrogen delivery systems would benefit many applications such as stationary power, portable power, and mobile vehicle industries.

Now, as reported in the journal Proceedings of the National Academy of Sciences, researchers have designed and synthesized an effective material for speeding up one of the limiting steps in extracting hydrogen from alcohols. The material, a catalyst, is made from tiny clusters of nickel metal anchored on a 2-D substrate. The team led by researchers at Lawrence Berkeley National Laboratory’s (Berkeley Lab) Molecular Foundry found that the catalyst could cleanly and efficiently accelerate the reaction that removes hydrogen atoms from a liquid chemical carrier. The material is robust and made from earth-abundant metals rather than existing options made from precious metals, and will help make hydrogen a viable energy source for a wide range of applications.

“We present here not merely a catalyst with higher activity than other nickel catalysts that we tested, for an important renewable energy fuel, but also a broader strategy toward using affordable metals in a broad range of reactions,” said Jeff Urban, the Inorganic Nanostructures Facility director at the Molecular Foundry who led the work. The research is part of the Hydrogen Materials Advanced Research Consortium (HyMARC), a consortium funded by the U.S. Department of Energy’s Office of Energy Efficiency and Renewable Energy Hydrogen and Fuel Cell Technologies Office (EERE). Through this effort, five national laboratories work towards the goal to address the scientific gaps blocking the advancement of solid hydrogen storage materials. Outputs from this work will directly feed into EERE’s H2@Scale vision for affordable hydrogen production, storage, distribution and utilization across multiple sectors in the economy.

Hong Kong scientists claim they have made a potential breakthrough discovery in the fight against infectious diseases—a chemical that could slow the spread of deadly viral illnesses.

A team from the University of Hong Kong described the newly discovered chemical as “highly potent in interrupting the life cycle of diverse viruses” in a study published this month in the journal Nature Communications.

The scientists told AFP Monday that it could one day be used as a broad-spectrum antiviral for a host of infectious diseases —and even for viruses that have yet to emerge—if it passes clinical trials.

Dr. Steve Horvath, a professor of genetics and biostatistics at UCLA, has found a way to measure biological aging – a type of “clock” – based on the methylation pattern of an organism’s genome. Methylations are biochemical processes that modify the activity of a DNA segment without changing its sequence – a type of epigenetic change. This video primer explains the basics of epigenetic clocks, the topic of our interview with Dr. Steve Horvath, coming soon!

Get the show notes here:
https://www.foundmyfitness.com/episodes/epigenetic-clock/

Continue reading “Epigenetic Aging: How old is your DNA?” »

However, a breakthrough by researchers at UVA’s College and Graduate School of Arts & Sciences, the California Institute of Technology and the U.S. Department of Energy’s Argonne National Laboratory, Lawrence Berkeley National Laboratory and Brookhaven National Laboratory could eliminate a critical obstacle from the process, a discovery that represents a giant stride toward a clean-energy future.

One way to harness solar energy is by using solar electricity to split water molecules into oxygen and hydrogen. The hydrogen produced by the process is stored as fuel, in a form that can be transferred from one place to another and used to generate power upon demand. To split water molecules into their component parts, a catalyst is necessary, but the catalytic materials currently used in the process, also known as the oxygen evolution reaction, are not efficient enough to make the process practical.

Meet the Smellicopter is a tiny drone developed by scientists at the University of Washington, capable of detecting smells like gas leaks, explosives, or even the survivors of a natural disaster. This amazing, obstacle avoiding UAV doesn’t use a man-made sensor to smell: it uses a moth antenna to navigate towards an odor.

A research paper published in IOP Science describes Smellicopter as “A bio-hybrid odor-guided autonomous palm-sized air vehicle.” The advantages to such a vehicle are clear: the tiny drone can travel in places that humans cannot or should not: the rubble of buildings after a natural disaster; zones where chemical leaks or spills may have occurred; or conflict zones that may contain chemical or explosive weapons.

Continue reading “Smellicopter Tiny Drone Uses Moth Antenna to Find Smells” »

How do molecular catalysts—molecules which, like enzymes, can trigger or accelerate certain chemical reactions—function, and what effects do they have? A team of chemists at the University of Oldenburg has come closer to the answers using a model molecule that functions like a molecular nanobattery. It consists of several titanium centers linked to each other by a single layer of interconnected carbon and nitrogen atoms. The seven-member research team recently published its findings, which combine the results of three multi-year Ph.D. research projects, in ChemPhysChem. The physical chemistry and chemical physics journal featured the basic research from Oldenburg on its cover.

To gain a better understanding of how the molecule works, the researchers, headed by first authors Dr. Aleksandra Markovic and Luca Gerhards and corresponding author Prof. Dr. Gunther Wittstock, performed electrochemical and spectroscopic experiments and used the university’s high-performance computing cluster for their calculations. Wittstock sees the publication of the paper as a “success story” for both the Research Training Groups within which the Ph.D. projects were conducted and for the university’s computing cluster. “Without the high-performance computing infrastructure, we would not have been able to perform the extensive calculations required to decipher the behavior of the molecule,” says Wittstock. “This underlines the importance of such computing clusters for current research.”

In the paper, the authors present the results of their analysis of a molecular structure, the prototype for which was the result of an unexpected chemical reaction first reported by the University of Oldenburg’s Chemistry Department in 2006. It is a highly complex molecular structure in which three titanium centers (commonly referred to in high school lessons as titanium ions) are connected to each other by a bridging ligand consisting of carbon and nitrogen. Such a compound would be expected to be able to accept and release several electrons through the exchange of electrons between the metal centers among other reasons.

Rusted iron pipes can react with residual disinfectants in drinking water distribution systems to produce carcinogenic hexavalent chromium in drinking water, reports a study by engineers at UC Riverside.

Chromium is a metal that occurs naturally in the soil and groundwater. Trace amounts of trivalent chromium eventually appear in the drinking water and food supply and are thought to have neutral effects on health. Chromium is often added to iron to make it more resistant to corrosion.

Certain chemical reactions can change chromium atoms into a hexavalent form that creates cancer-causing genetic mutations in cells. This carcinogenic form of chromium was at the heart of a lawsuit in California’s Central Valley by Erin Brockovich, which became the subject of an Oscar-winning movie.

A startup with a new type of spacecraft propulsion system could make the interplanetary travel seen in Star Trek a reality. Magdrive has just closed a £1.4M seed round led by Founders Fund, an early investor in SpaceX, backed by Luminous Ventures, 7percent Ventures, and Entrepreneur First.

Magdrive is developing a next generation of spacecraft propulsion for small satellites. The startup says its engine’s thrust and efficiency are a “generational leap” ahead of any other electrical thrusters, opening up the space industry to completely new types of missions that were not possible before, without resorting to much larger, expensive and heavier chemical thrusters. It says its engine would make fast and affordable interplanetary space travel possible, as well as operations in Very Low Earth orbit. The engine would also make orbital manufacturing far more possible than previously.

Existing electrical solutions are very efficient but have very low thrust. Chemical thrusters have high thrust but lack efficiency and are hazardous and expensive to handle. Magdrive says its engine can deliver both high thrust and high efficiency in one system.