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Artificial intelligence helps explore chemistry frontiers

The ability to simulate the behavior of systems at the atomic level represents a powerful tool for everything from drug design to materials discovery. A team led by Los Alamos National Laboratory .

Kipton barrosBenjamin nebgenRicharda messerlyLos alamosBenjamint nebgenOlexandr isayevShuhao zhangSergei tretiakJustins smithRichard messerlyRyanb jadrichNicholas lubbersElfi krakaNature chemistry

SMU Chemist and Colleagues Develop Machine Learning Model for Atomic-level Interactions

Machine learning interatomic potentials (MLIP)s have become an efficient and less expensive alternative to traditional quantum chemical simulations.

Oak ridgeUnited statesRyan jadrichOlexandr isayevSergei tretiakKipton barrosJustin smithElfi krakaRichard messerlyErin prather staffordShuhao zhangBenjamint nebgenNicholas lubbersOak ridge national laboratoryNational science foundationCarnegie mellon university

SMU Chemist Leads in Creating Machine Learning Model for Atoms

SMU Chemist Leads in Creating Machine Learning Model for Atoms
miragenews.com - get the latest breaking news, showbiz & celebrity photos, sport news & rumours, viral videos and top stories from miragenews.com Daily Mail and Mail on Sunday newspapers.

Oak ridgeUnited statesOlexandr isayevKipton barrosElfi krakaNicholas lubbersRyan jadrichJustin smithShuhao zhangRichard messerlySergei tretiakBenjamint nebgenOak ridge national laboratoryNational science foundationComputational and theoretical chemistry groupCarnegie mellon university

Researchers develop new machine learning method for modeling of chemical reactions

Researchers from Carnegie Mellon University and Los Alamos National Laboratory have used machine learning to create a model that can simulate reactive processes in a diverse set of organic materia .

Benjamint nebgenRicharda messerlyShuhao zhangKipton barrosJustins smithSergei tretiakCarnegie mellonRyanb jadrichNicholas lubbersOlexandr isayevElfi krakaCarnegie mellon university department of chemistryCarnegie mellon universityGeneral reactive machine learning potentialNature chemistryNano sponge revolution

Carnegie Mellon Researchers Develop New Machine Learning Method For Modeling Of Chemical Reactions

Carnegie Mellon Researchers Develop New Machine Learning Method For Modeling Of Chemical Reactions
chemicalonline.com - get the latest breaking news, showbiz & celebrity photos, sport news & rumours, viral videos and top stories from chemicalonline.com Daily Mail and Mail on Sunday newspapers.

Olexandr isayevRyanb jadrichBenjamint nebgenRicharda messerlyKipton barrosCarnegie mellonJustins smithNicholas lubbersSergei tretiakShuhao zhangElfi krakaOffice of naval researchLos alamos national laboratoryCarnegie mellon university department of chemistryEnergetic materials program to isayevCarnegie mellon university