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July 2nd, 2015

Computational Chemistry’s Latest News Stories

Supercomputers help solve puzzle-like bond for biofuels

One of life's strongest bonds has been discovered by a science team researching biofuels with the help of supercomputers Their find could boost efforts to develop catalysts for biofuel production from non food waste plants ... - Read More

Chemists develop 'looking glass' for spotting sound molecular structures

New York University chemists have developed a computational approach for determining the viability and suitability of complex molecular structures an advancement that could aid in the development of pharmaceuticals as well as a range of ... - Read More

NYU Chemists Develop "Looking Glass" for Spotting Sound Molecular Structures

dissolving once ingested and not in the bottle in the case of pharmaceuticals or maintaining their form under harsh weather conditions in the case of construction materials In order to understand the how best to ... - Read More

Superatomic Nickel core and unusual molecular reactivity

Scientists in Russian Academy of Sciences Moscow have revealed a unique molecular fragment Ni2O2 consisting of two nickel atoms and two oxygen atoms that have shown plausible superatomic properties Supeatoms are important structural elements in ... - Read More

Creation of 'rocker' protein opens way for new smart molecules in medicine, other fields

Human cells are protected by a largely impenetrable molecular membrane but researchers have built the first artificial transporter protein that carries individual atoms across membranes opening the possibility of engineering a new class of smart ... - Read More

Ultrafast complex molecular simulations by ‘cutting up molecules’

Scientists at ITbM Nagoya University and AIST have developed an ultrafast quantum chemical method which allows rapid and accurate simulations of complex molecular systems consisting of thousands of molecules Nagoya Japan Professor Stephan Irle and ... - Read More

Computer program could help solve arson cases

Sifting through the chemical clues left behind by arson is delicate time consuming work but University of Alberta researchers teaming with RCMP scientists in Canada have found a way to speed the process A computer ... - Read More

New method gives accurate picture of gas storage by microscopic cages

Gas
A computational method to quantify the adsorption of gas by porous zeolites should help labs know what to expect before they embark upon slow costly experiments according to researchers at Rice University The new method ... - Read More

New computational approaches speed up the exploration of the universe

Computational, computational, Computational
How many different molecules can be created when you release one of the universe's most reactive substances hydrogen cyanide in the lab And will the process create some particularly interesting molecules That is what scientists ... - Read More

Computational chemistry draws for first time 'interactive cartographic map' of enzymes during chemical reactions

Knowing how enzymes work is key to control the chemical processes involving these biological macromolecules that have countless applications in the fields of medicine and industry Computational chemistry has enabled to draw for the first ... - Read More

Most Popular Articles

Graphene Researchers Create "Superheated" Water That Can Corrode Diamonds

Released 3 11 2013 5 00 AM EDTSource Newsroom National University of Singapore more news from this source Mar 11 2013 A team of researchers from the National University of Singapore NUS led by Professor ...

Gentle pasteurization of milk – with microwaves
Microwaves, Milk

In the EU funded project MicroMilk European SMEs together with the University of Hohenheim and the Fraunhofer IGB have developed a novel method for pasteurization of milk with microwaves The system preserves the valuable components ...

Ultrasound ‘Making Waves’ for Enhancing Biofuel Production

All chefs know that you have to break some eggs to make an omelet and that includes engineers at Iowa State University who are using high frequency sound waves to break down plant materials in ...

Researchers "Fish New Pond" for Antibiotics

Released 10 11 2013 9 35 AM EDTEmbargo expired 10 13 2013 1 00 PM EDTSource Newsroom McMaster University more news from this source Oct 15 2013 Hamilton ON Oct 13 2013 Researchers at McMaster ...

Warming since 1950s partly caused by El Niño
Ocean, Ocean

A natural shift to stronger warm El Niño events in the Pacific Ocean might be responsible for a substantial portion of the global warming recorded during the past 50 years according to new research at ...

Geochemistry survey at Chatham Rise reveals absence of modern day greenhouse gas emissions
Gas, Geochemistry, Emissions

Geochemistry analysis conducted by the U S Naval Research Laboratory of fossil sediment injection structures off the New Zealand coast in February and March reveal no presence of modern day expulsions of methane gas a ...

Most Popular Topics
Materials   Chemistry   Chemical   energy   Energy   Science   chemical   Water   Time   Water   Energy   energy   chemical   Chemical   Engineering   Material   Water   Organic   molecules   Carbon   Light   cells   Earth   Molecular  

More Computational Chemistry’s Latest News

Researchers unmask Janus-faced nature of mechanical forces with supercomputer

Reaction, Reaction
The harder you pull the quicker it goes At least that used to be the rule in mechanochemistry a method that researchers apply to set chemical reactions in motion by means of mechanical forces However ... - Read More

Molecular coordination in evolution

no picA CNIO team led by Alfonso Valencia has revised the latest methodologies for studying the evolution and interaction of proteins as well as future applications for selective drug development Share This See Also Molecular Biology ... - Read More

Scientists confirm original tetrahedral model of molecular structure of water

molecular structure
Researchers at Johannes Gutenberg University Mainz JGU have confirmed the original model of the molecular structure of water and have thus made it possible to resolve a long standing scientific controversy about the structure of ... - Read More

Protein origami: Quick folders are the best

Protein, Protein
The evolutionary history of proteins shows that protein folding is an important factor Especially the speed of protein folding plays a key role This was the result of a computer analysis carried out by researchers ... - Read More

Chemical reactions: How some non-metal compounds mimic the behavior of their metal-based counterparts

chemical, Reactions
The research team led by Academy Research Fellow Heikki M Tuononen has been able to identify the mechanism which enables some non metal compounds to mimic the reactivity of their metal based counterparts Chemical reactivity ... - Read More
View more Computational Chemistry Articles

Chemical Kinetics

Uncovering a reaction's secrets

A theoretical and experimental study could lead to improved catalysts for producing hydrogen fuel from waste biomass Experimental analysis and computer simulations reveal new insights into the process by which ethanol produced from waste biomass ...

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