Tikhonov D A, Polozov R V, Gorelov A V, Timoshenko E G, Kuznetsov Iu A, Panchenko L A, Dawson K A
Biofizika. 1997 Sep-Oct;42(5):1066-78.
Based on the numerical algorithm proposed by us in [1] for solving integral equations of the theory of liquids in the RISM approximation we calculate all of the solvent-solute atom-atom correlation functions for a fragment of the DNA duplex d(GGGGG) in infinitely diluted aqueous solution. The obtained results are compared with available experimental data and results from computer simulations.
基于我们在[1]中提出的数值算法，用于求解RISM近似下液体理论中的积分方程，我们计算了无限稀释水溶液中DNA双链体d(GGGGG)片段的所有溶剂-溶质原子-原子相关函数。将所得结果与现有的实验数据和计算机模拟结果进行了比较。
