Generalized Euler equations for linked rigid bodies

Numerical integration of the cartesian equations of motion of a system with constraints: molecular dynamics of n-alkanes

1977 • 19,896 citations

Computer Simulation of Liquids

1988 • 15,963 citations

Molecular Dynamics Study of Liquid Water

1971 • 1,365 citations

Rotations, quaternions, and double groups

1986 • 784 citations

Singularity free algorithm for molecular dynamics simulation of rigid polyatomics

1977 • 488 citations

Molecular dynamics of rigid systems in cartesian coordinates A general formulation

1982 • 334 citations

Constrained molecular dynamics: Simulations of liquid alkanes with a new algorithm

1986 • 270 citations

Leapfrog Rotational Algorithms

1992 • 270 citations

New Methodology for Computer-Aided Modelling of Biomolecular Structure and Dynamics 1. Non-Cyclic Structures

1989 • 116 citations

Derivation and testing of explicit equations of motion for polymers described by internal coordinates

1991 • 71 citations

Leapfrog Rotational Algorithms for Linear Molecules

1993 • 33 citations

A Method to Calculate the g-Coefficients of the Molecular Pair Correlation Function from Molecular Dynamics Simulations

1989 • 10 citations