Efficient Coarse-Grained Molecular Simulations in the Multibody Dynamics Scheme

Author:

Poursina Mohammad,Anderson Kurt S.

Publisher

Springer Netherlands

Reference78 articles.

1. Abagyan, R., Mazur, A.: New methodology for computer-aided modeling of biomolecular structure and dynamics. 2. Local deformations and cycles. J. Comput. Phys. 6(4), 833–845 (1989)

2. Anderson, K.S.: Recursive derivation of explicit equations of motion for efficient dynamic/control simulation of large multibody systems. Ph.D. thesis, Stanford University (1990)

3. Anderson, K.S., Poursina, M.: Energy concern in biomolecular simulations with transition from a coarse to a fine model. In: Proceedings of the Seventh International Conference on Multibody Systems, Nonlinear Dynamics and Control, ASME Design Engineering Technical Conference 2009 (IDETC09), IDETC2009/MSND-87297, San Diego, CA (2009)

4. Anderson, K.S., Poursina, M.: Optimization problem in biomolecular simulations with DCA-based modeling of transition from a coarse to a fine fidelity. In: Proceedings of the Seventh International Conference on Multibody Systems, Nonlinear Dynamics and Control, ASME Design Engineering Technical Conference 2009 (IDETC09), IDETC2009/MSND-87319, San Diego, CA (2009)

5. Appel, A.W.: An efficient program for many-body simulation. SIAM J. Sci. Stat. Comput. 6(1), 85–103 (1985)

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