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Theory of electrostatic effects in soft biological interfaces using atomic force microscopy.

机译:使用原子力显微镜在软生物界面中静电效应的理论。

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摘要

We calculated the electrostatic force between a planar interface, such as a planar-supported lipid bilayer membrane, and the tip of a stylus on which another lipid bilayer or some other biomacromolecular system might be deposited. We considered styli with rounded tips as well as conical tips. To take into account the effect of dynamical hydrogen-bonded structures in the aqueous phase, we used a theory of nonlocal electrostatics. We used the Derjaguin approximation and identified the systems for which its use is valid. We pointed out where our approach differs from previous calculations and to what extent the latter are inadequate. We found that 1) the nonlocal interactions have significant effects over distances of 10-15 A from the polar zone and that, at the surface of this zone, the effect on the calculated force can be some orders of magnitude; 2) the lipid dipoles and charges are located a distance L from the hydrophobic layer in the aqueous medium and this can have consequences that may not be appreciated if it is ignored; 3) dipoles, located in the aqueous region, can give rise to forces even though the polar layer is unchanged, and if this is ignored the interpretation of force data can be erroneous if an attempt is made to rationalize an observed force with a knowledge of an uncharged surface; 4) the shape of the stylus tip can be very important, and a failure to take this into account can result in incorrect conclusions, a point made by other workers; and 5) when L is nonzero, the presence of charges and dipoles can yield a force that can be nonmonotonic as a function of ionic concentration.
机译:我们计算了平面界面(例如,平面支撑的脂质双层膜)与手写笔尖端之间的静电力,在其上可能沉积了另一个脂质双层或某些其他生物大分子系统。我们考虑了带有圆形尖端和锥形尖端的测针。考虑到水相中动态氢键结构的影响,我们使用了非局部静电学说。我们使用了Derjaguin逼近,并确定了对其有效的系统。我们指出了我们的方法与先前的计算方法有何不同,以及后者在多大程度上不足。我们发现:1)非局部相互作用在距极区10-15 A的距离上具有显着影响,并且在该区域的表面,对计算力的影响可能会达到几个数量级; 2)脂质偶极子和电荷位于水性介质中距疏水层的距离L处,如果忽略不计,可能会产生无法理解的后果; 3)即使在极性层未变的情况下,位于水域的偶极子也会产生力,并且如果忽略了这一点,则如果尝试在了解以下情况的情况下合理化观测到的力,则对力数据的解释可能是错误的。不带电的表面; 4)测针尖的形状可能非常重要,如果不考虑这一点,可能会导致错误的结论,这是其他工人提出的观点; 5)当L不为零时,电荷和偶极子的存在会产生一个随离子浓度而变的非单调力。

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