Abstract
The principles and practice of a many-body Brownian dynamics algorithm of reversible binding to a static three-dimensional receptor array are presented. The mixed boundary conditions at the array are compared with single-particle direct propagation using a novel operator discretization. The many-body aspects are checked against previous one-dimensional Brownian simulations. The long-time behavior agrees with expected analytic solutions.
| Original language | English |
|---|---|
| Pages (from-to) | 260-275 |
| Number of pages | 16 |
| Journal | Journal of Computational Physics |
| Volume | 132 |
| Issue number | 2 |
| DOIs | |
| State | Published - Apr 1997 |
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