Sotirios I. Pantos and Ekaterini Tiligada Protein backbone structure determination using RDC: An inverse kinematics approach with fast and exact solutions International Journal of Quantum Chemistry 113
Most of the existing computational methods for protein structure determination with nuclear magnetic resonace (NMR) rely on stochastic and heuristic protocols overlooking the fast analytic-type algebraic methods as unrealistic alternates. An algebraic methodology is here introduced to reinforce this alternate point of view as realistic and effective. A unified and efficient methodology that reduces the computations of protein backbone conformation to a problem of robust, easily soluble, linear and nonlinear equation solving is introduced.
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