英语词汇“computational chemistry”的英英意思、用法、释义、翻译、读音、例句、短语、词组-英语词典

单词	computational chemistry
释义	DictionarySeechemistry computational chemistry computational chemistry [‚käm·pyə′tā·shən·əl ′kem·ə·strē] (chemistry) The use of calculations to predict molecular structure, properties, and reactions. computational chemistry Computer-driven design of molecules, modelling and prediction of chemical structures likely to bind potential protein drug targets computational chemistry The use of mathematical formulas to simulate or study a variety of chemical characteristics, including a compound's electronic structure, geometry, potential energy, and kinetic rate constants.See also: chemistry
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