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Glenn Martyna
Glenn Martyna
Pimpernel Science, Software and Information Technology
Verified email at pimpernelllc.com - Homepage
Title
Cited by
Cited by
Year
Constant pressure molecular dynamics algorithms
GJ Martyna, DJ Tobias, ML Klein
The Journal of chemical physics 101 (5), 4177-4189, 1994
53151994
Nosé–Hoover chains: The canonical ensemble via continuous dynamics
GJ Martyna, ML Klein, M Tuckerman
The Journal of chemical physics 97 (4), 2635-2643, 1992
51771992
Reversible multiple time scale molecular dynamics
M Tuckerman, BJ Berne, GJ Martyna
The Journal of chemical physics 97 (3), 1990-2001, 1992
40381992
Explicit reversible integrators for extended systems dynamics
GJ Martyna, ME Tuckerman, DJ Tobias, ML Klein
Molecular Physics 87 (5), 1117-1157, 1996
20891996
A reciprocal space based method for treating long range interactions in ab initio and force-field-based calculations in clusters
GJ Martyna, ME Tuckerman
The Journal of chemical physics 110 (6), 2810-2821, 1999
7541999
A Liouville-operator derived measure-preserving integrator for molecular dynamics simulations in the isothermal–isobaric ensemble
ME Tuckerman, J Alejandre, R López-Rendón, AL Jochim, GJ Martyna
Journal of Physics A: Mathematical and General 39 (19), 5629, 2006
6252006
Understanding modern molecular dynamics: Techniques and applications
ME Tuckerman, GJ Martyna
The Journal of Physical Chemistry B 104 (2), 159-178, 2000
5542000
Efficient molecular dynamics and hybrid Monte Carlo algorithms for path integrals
ME Tuckerman, BJ Berne, GJ Martyna, ML Klein
The Journal of Chemical Physics 99 (4), 2796-2808, 1993
5451993
Chemical doping of large-area stacked graphene films for use as transparent, conducting electrodes
A Kasry, MA Kuroda, GJ Martyna, GS Tulevski, AA Bol
ACS nano 4 (7), 3839-3844, 2010
4072010
Non-Hamiltonian molecular dynamics: Generalizing Hamiltonian phase space principles to non-Hamiltonian systems
ME Tuckerman, Y Liu, G Ciccotti, GJ Martyna
The Journal of Chemical Physics 115 (4), 1678-1702, 2001
3712001
Blue Gene: A vision for protein science using a petaflop supercomputer
F Allen, G Almasi, W Andreoni, D Beece, BJ Berne, A Bright, J Brunheroto, ...
IBM systems journal 40 (2), 310-327, 2001
3522001
Molecular dynamics algorithm for multiple time scales: Systems with long range forces
ME Tuckerman, BJ Berne, GJ Martyna
The Journal of chemical physics 94 (10), 6811-6815, 1991
3101991
Symplectic quaternion scheme for biophysical molecular dynamics
TF Miller Iii, M Eleftheriou, P Pattnaik, A Ndirango, D Newns, GJ Martyna
The Journal of chemical physics 116 (20), 8649-8659, 2002
3042002
Exploiting multiple levels of parallelism in molecular dynamics based calculations via modern techniques and software paradigms on distributed memory computers
ME Tuckerman, DA Yarne, SO Samuelson, AL Hughes, GJ Martyna
Computer Physics Communications 128 (1-2), 333-376, 2000
2452000
Molecular dynamics algorithms for path integrals at constant pressure
GJ Martyna, A Hughes, ME Tuckerman
The Journal of chemical physics 110 (7), 3275-3290, 1999
2331999
On the classical statistical mechanics of non-Hamiltonian systems
ME Tuckerman, CJ Mundy, GJ Martyna
Europhysics Letters 45 (2), 149, 1999
2041999
Base-by-base ratcheting of single stranded DNA through a solid-state nanopore
B Luan, G Martyna, G Stolovitzky, H Peng, S Polonsky, S Rossnagel
Biophysical Journal 98 (3), 422a, 2010
1922010
Molecular dynamics simulations of a protein in the canonical ensemble
DJ Tobias, GJ Martyna, ML Klein
The Journal of Physical Chemistry 97 (49), 12959-12966, 1993
1811993
Molecular dynamics algorithm for condensed systems with multiple time scales
ME Tuckerman, GJ Martyna, BJ Berne
The Journal of chemical physics 93 (2), 1287-1291, 1990
1781990
Behavior of the hydrated electron at different temperatures: structure and absorption spectrum
A Wallqvist, G Martyna, BJ Berne
The Journal of Physical Chemistry 92 (7), 1721-1730, 1988
1671988
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