The ABEEM/MM (atom-bond electronegativity equalization fused into molecular mechanic) fluctuating charge force field was used in molecular dynamic simulation for N-methylacetamide (NMA) aqueous solution.

• 利用原子键电负性均衡结合分子力场方法(ABEEM/MM)对N-甲基乙酰胺(NMA)分子的水溶液体系进行了分子动力学模拟.