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量子药理学是用量子力学的理论和方法研究药理学问题的一门新兴学科。它的出现标志着药理学的研究已跨入了微观世界,同时使其向数字化发展迈进了一大步。本世纪前,药物化学家试图寻找药物化学结构与其生物活性之间的定量关系,但由于量子分子力学的计算过程极为复杂而使这项工作的开展一度搁浅。在本世纪五十年代,开始有人用电子结构解释维生素和激素的活性关系。接着在1970年Purcell等的倡导下,建立了国际量子生物学学会(ISQB)。当
Quantum pharmacology is a new discipline that studies the pharmacological problems with the theories and methods of quantum mechanics. Its appearance marks that the research of pharmacology has entered the micro-world and at the same time has taken it a big step toward digitalization. This century, drug chemists tried to find the quantitative relationship between the chemical structure of a drug and its biological activity. However, the work of this work was stalled due to the extremely complicated calculation process of quantum molecular mechanics. In the fifties of this century, some people started to explain the relationship between vitamins and hormones by electronic structure. Then, at the initiative of Purcell et al. In 1970, the International Society for Quantum Biology (ISQB) was established. when