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Computational chemistry is a branch of chemistry that uses computer simulations to assist in solving chemical problems. [1] It uses methods of theoretical chemistry incorporated into computer programs to calculate the structures and properties of molecules , groups of molecules, and solids. [ 2 ]
John Pople (1925–2004), winner of 1998 Nobel Prize in Chemistry "for his development of computational methods in quantum chemistry", developer of Pariser–Parr–Pople method; Alberte Pullman (1920–2011), pioneered the application of quantum chemistry to predicting the carcinogenic properties of aromatic hydrocarbons.
Quantum computational chemistry is an emerging field that exploits quantum computing to simulate chemical systems. Despite quantum mechanics' foundational role in understanding chemical behaviors, traditional computational approaches face significant challenges, largely due to the complexity and computational intensity of quantum mechanical equations.
Average salary: $143,184. Key skills and experience needed: Applied mathematics, machine learning, deep learning, computational statistics, computer perception and natural language processing.
From June 2009 to December 2012, if you bought shares in companies when Arthur C. Martinez joined the board, and sold them when he left, you would have a 52.2 percent return on your investment, compared to a 55.1 percent return from the S&P 500.
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Chemical Computing Group is a software company specializing in research software for computational chemistry, bioinformatics, cheminformatics, docking, pharmacophore searching and molecular simulation. The company's main customer base consists of pharmaceutical and biotechnology companies, as well as academic research groups.
Average salary: $117,300 Memory importance score: 56 Physicists c onduct research into physical phenomena, develop theories on the basis of observation and experiments, and devise methods to apply ...
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