A fast recursive algorithm for molecular dynamics simulation
- 30 June 1993
- journal article
- Published by Elsevier in Journal of Computational Physics
- Vol. 106 (2), 258-268
- https://doi.org/10.1016/s0021-9991(83)71106-x
Abstract
No abstract availableThis publication has 13 references indexed in Scilit:
- A Spatial Operator Algebra for Manipulator Modeling and ControlThe International Journal of Robotics Research, 1991
- Derivation and testing of explicit equations of motion for polymers described by internal coordinatesJournal of Computational Physics, 1991
- Protein molecular dynamics constrained to slow modes: theoretical approach based on a hierarchy of local modes with a set of holonomic constraints; the method and its tests on citrate synthaseThe Journal of Physical Chemistry, 1991
- Variable step molecular dynamics: An exploratory technique for peptides with fixed geometryJournal of Computational Chemistry, 1990
- New Methodology for Computer-Aided Modelling of Biomolecular Structure and Dynamics 1. Non-Cyclic StructuresJournal of Biomolecular Structure and Dynamics, 1989
- Algorithms for computing the dynamical trajectories of flexible bodiesMolecular Physics, 1988
- Simulation of free energy relationships and dynamics of SN2 reactions in aqueous solutionJournal of the American Chemical Society, 1988
- Constrained molecular dynamics: Simulations of liquid alkanes with a new algorithmThe Journal of Chemical Physics, 1986
- CHARMM: A program for macromolecular energy, minimization, and dynamics calculationsJournal of Computational Chemistry, 1983
- Brownian dynamics study of a polymer chain of linked rigid bodiesThe Journal of Chemical Physics, 1979