Arbitrary-shape dielectric particles interacting in the linearized Poisson-Boltzmann framework: an analytical treatment
收藏资源简介:
h_kmlsn.mat -- the coefficients h<sub>kmls,n</sub> calculated for n_max<=50: one has h<sub>kmls,n</sub> = h<sub>kmlsn</sub>(k+1,m+1,l+1,s+1,n+1), where h<sub>kmlsn</sub> is a 5D array contained in h_kmlsn.mat (note that MATLAB indices must start from 1, while mathematically indices k, m, l, s, and n are >=0). b_nml_approx.m -- it approximates $b_{nml}(\tilde r,\tilde R)$ with a given parameter n_max; derivative_b_nml_approx.m -- it approximates the derivative of $b_{nml}(\tilde r,\tilde R)$ with respect to $\tilde r$ with a given parameter n_max; linear_system_two_bodies_direct_backslash.m -- a simple example of forming the global linear system (14) and solving it directly (without regularization) using the MATLAB "mldivide" (or backslash) operation GSK3beta.zip -- zipped directory with DelPhi files related to Sec. 5.1.3 (see ReadmeGSK3beta.txt); Arginine-Glutamate -- zipped directory with DelPhi files related to Sec. 5.1.4 (see ReadmeARGGlu.txt)



