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  • Title: RMCSANS--modelling the inter-particle term of small angle scattering data via the reverse Monte Carlo method.
    Author: Gereben O, Pusztai L, McGreevy RL.
    Journal: J Phys Condens Matter; 2010 Oct 13; 22(40):404216. PubMed ID: 21386577.
    Abstract:
    A new reverse Monte Carlo (RMC) method has been developed for creating three-dimensional structures in agreement with small angle scattering data. Extensive tests, using computer generated quasi-experimental data for aggregation processes via constrained RMC and Langevin molecular dynamics, were performed. The software is capable of fitting several consecutive time frames of scattering data, and movie-like visualization of the structure (and its evolution) either during or after the simulation is also possible.
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