We propose a novel avenue for state space reduction in spin dynamics simulations, using
detectability as a selection criterion–only those states that evolve into or affect other …

We extend the recently proposed state-space restriction (SSR) technique for quantum spin
dynamics simulations [Kuprov et al., J. Magn. Reson. 189 (2007) 241–250] to include on-the …

We report progress with an old problem in magnetic resonance—that of the exponential
scaling of simulation complexity with the number of spins. It is demonstrated below that a …

We present an algebraic foundation for the state space restriction approximation in spin
dynamics simulations and derive applicability criteria as well as minimal basis set …

In this paper we present a new open source package, Spin-Scenario, aimed at developing
an intuitive, flexible and unique scripting framework able to cover many aspects of …

We introduce a new method, based on alternating optimization, for compact representation
of spin Hamiltonians and solution of linear systems of algebraic equations in the tensor train …

We introduce a simple and general XML format for spin system description that is the result
of extensive consultations within Magnetic Resonance community and unifies under one …

Several methods are proposed for the analysis, visualization and interpretation of high-
dimensional spin system trajectories produced by quantum mechanical simulations. It is …

We propose a solution to the matrix dimension problem in quantum mechanical simulations
of MRI (magnetic resonance imaging) experiments on complex molecules. This problem is …

We propose three basis screening methods for state space restriction in Liouville space
simulations of large densely coupled spin systems encountered in electron paramagnetic …