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本文用 MNDO方法在 VAX835 0计算机上对香茶菜酸和道浮香茶菜乙素进行了量子化学计算研究 .给出了分子轨道及其能级、电荷密度、键级 .并对其电子结构与抗癌活性的关系进行了讨论
In this paper, MNDO method was used on a computer VAX835 0 cypermethrin and Daphne Ampelopacenin Quantum chemical calculation studies are given molecular orbital and its energy level, charge density, bond level and its electronic structure The relationship with anti-cancer activity was discussed