Ontology highlight
ABSTRACT:
SUBMITTER: Antosiewicz J
PROVIDER: S-EPMC1236364 | biostudies-other | 1995 Oct
REPOSITORIES: biostudies-other
A simple and computationally feasible procedure for the calculation of net charges and dipole moments of proteins at arbitrary pH and salt conditions is described. The method is intended to provide data that may be compared to the results of transient electric dichroism experiments on protein solutions. The procedure consists of three major steps: (i) calculation of self energies and interaction energies for ionizable groups in the protein by using the finite-difference Poisson-Boltzmann method, ...[more]