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1. Tuckerman, ME; Martyna, GJ
   Understanding modern molecular dynamics: Techniques and applications (vol 105B, pg 159, 2000)
   JOURNAL OF PHYSICAL CHEMISTRY B
   
   M.E. Tuckerman e G.J. Martyna, "Understanding modern molecular dynamics: Techniques and applications (vol 105B, pg 159, 2000)", J PHYS CH B, 105(31), 2001, pp. 7598-7598
2. Ciccotti, G; Martyna, GJ; Melchionna, S; Tuckerman, ME
   Constrained isothermal-isobaric molecular dynamics with full atomic virial
   JOURNAL OF PHYSICAL CHEMISTRY B
   
   G. Ciccotti et al., "Constrained isothermal-isobaric molecular dynamics with full atomic virial", J PHYS CH B, 105(28), 2001, pp. 6710-6715
3. Yarne, DA; Tuckerman, ME; Martyna, GJ
   A dual length scale method for plane-wave-based, simulation studies of chemical systems modeled using mixed ab initio/empirical force field descriptions
   JOURNAL OF CHEMICAL PHYSICS
   
   D.A. Yarne et al., "A dual length scale method for plane-wave-based, simulation studies of chemical systems modeled using mixed ab initio/empirical force field descriptions", J CHEM PHYS, 115(8), 2001, pp. 3531-3539
4. Tuckerman, ME; Liu, Y; Ciccotti, G; Martyna, GJ
   Non-Hamiltonian molecular dynamics: Generalizing Hamiltonian phase space principles to non-Hamiltonian systems
   JOURNAL OF CHEMICAL PHYSICS
   
   M.E. Tuckerman et al., "Non-Hamiltonian molecular dynamics: Generalizing Hamiltonian phase space principles to non-Hamiltonian systems", J CHEM PHYS, 115(4), 2001, pp. 1678-1702
5. Tuckerman, ME; Martyna, GJ
   Understanding modern molecular dynamics: Techniques and applications
   JOURNAL OF PHYSICAL CHEMISTRY B
   
   M.E. Tuckerman e G.J. Martyna, "Understanding modern molecular dynamics: Techniques and applications", J PHYS CH B, 104(2), 2000, pp. 159-178
6. Mundy, CJ; Balasubramanian, S; Bagchi, K; Tuckerman, ME; Martyna, GJ; Klein, ML
   Nonequilibrium molecular dynamics
   REVIEWS IN COMPUTATIONAL CHEMISTRY, VOL 14
   
   C.J. Mundy et al., "Nonequilibrium molecular dynamics", REV COMP CH, 14, 2000, pp. 291-397
7. Bug, ALR; Martyna, GJ
   Calculation of neutron spectra for hydrogen in zeolites: rotational motions and translational motions in the Born-Oppenheimer limit
   CHEMICAL PHYSICS
   
   A.L.R. Bug e G.J. Martyna, "Calculation of neutron spectra for hydrogen in zeolites: rotational motions and translational motions in the Born-Oppenheimer limit", CHEM PHYS, 261(1-2), 2000, pp. 89-110
8. Balog, E; Hughes, AL; Martyna, GJ
   Constant pressure path integral molecular dynamics studies of quantum effects in the liquid state properties of n-alkanes
   JOURNAL OF CHEMICAL PHYSICS
   
   E. Balog et al., "Constant pressure path integral molecular dynamics studies of quantum effects in the liquid state properties of n-alkanes", J CHEM PHYS, 112(2), 2000, pp. 870-880
9. Tuckerman, ME; Yarne, DA; Samuelson, SO; Hughes, AL; Martyna, GJ
   Exploiting multiple levels of parallelism in Molecular Dynamics based calculations via modern techniques and software paradigms on distributed memorycomputers
   COMPUTER PHYSICS COMMUNICATIONS
   
   M.E. Tuckerman et al., "Exploiting multiple levels of parallelism in Molecular Dynamics based calculations via modern techniques and software paradigms on distributed memorycomputers", COMP PHYS C, 128(1-2), 2000, pp. 333-376
10. Tarek, M; Martyna, GJ; Tobias, DJ
    Amplitudes and frequencies of protein dynamics: Analysis of discrepancies between neutron scattering and molecular dynamics simulations
    JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
    
    M. Tarek et al., "Amplitudes and frequencies of protein dynamics: Analysis of discrepancies between neutron scattering and molecular dynamics simulations", J AM CHEM S, 122(42), 2000, pp. 10450-10451
11. Samuelson, S; Martyna, GJ
    Computer simulation studies of finite temperature conformational equilibrium in alanine-based peptides
    JOURNAL OF PHYSICAL CHEMISTRY B
    
    S. Samuelson e G.J. Martyna, "Computer simulation studies of finite temperature conformational equilibrium in alanine-based peptides", J PHYS CH B, 103(10), 1999, pp. 1752-1766
12. Tuckerman, ME; Mundy, CJ; Martyna, GJ
    On the classical statistical mechanics of non-Hamiltonian systems
    EUROPHYSICS LETTERS
    
    M.E. Tuckerman et al., "On the classical statistical mechanics of non-Hamiltonian systems", EUROPH LETT, 45(2), 1999, pp. 149-155
13. Tuckerman, ME; Martyna, GJ
    "Comment on 'Simple reversible molecular dynamics algorithms for Nose-Hoover chain dynamics' " (vol 110, pg 3623, 1999)
    JOURNAL OF CHEMICAL PHYSICS
    
    M.E. Tuckerman e G.J. Martyna, ""Comment on 'Simple reversible molecular dynamics algorithms for Nose-Hoover chain dynamics' " (vol 110, pg 3623, 1999)", J CHEM PHYS, 111(7), 1999, pp. 3313-3313
14. Diraison, M; Martyna, GJ; Tuckerman, ME
    Simulation studies of liquid ammonia by classical ab initio, classical, and path-integral molecular dynamics
    JOURNAL OF CHEMICAL PHYSICS
    
    M. Diraison et al., "Simulation studies of liquid ammonia by classical ab initio, classical, and path-integral molecular dynamics", J CHEM PHYS, 111(3), 1999, pp. 1096-1103
15. Martyna, GJ; Hughes, A; Tuckerman, ME
    Molecular dynamics algorithms for path integrals at constant pressure
    JOURNAL OF CHEMICAL PHYSICS
    
    G.J. Martyna et al., "Molecular dynamics algorithms for path integrals at constant pressure", J CHEM PHYS, 110(7), 1999, pp. 3275-3290
16. Tuckerman, ME; Martyna, GJ
    Comment on "Simple reversible molecular dynamics algorithms for Nose-Hoover chain dynamics" [J. Chem. Phys. 107, 9514, 1997]
    JOURNAL OF CHEMICAL PHYSICS
    
    M.E. Tuckerman e G.J. Martyna, "Comment on "Simple reversible molecular dynamics algorithms for Nose-Hoover chain dynamics" [J. Chem. Phys. 107, 9514, 1997]", J CHEM PHYS, 110(7), 1999, pp. 3623-3625
17. Martyna, GJ; Tuckerman, ME
    A reciprocal space based method for treating long range interactions in abinitio and force-field-based calculations in clusters
    JOURNAL OF CHEMICAL PHYSICS
    
    G.J. Martyna e M.E. Tuckerman, "A reciprocal space based method for treating long range interactions in abinitio and force-field-based calculations in clusters", J CHEM PHYS, 110(6), 1999, pp. 2810-2821
18. Marx, D; Tuckerman, ME; Martyna, GJ
    Quantum dynamics via adiabatic ab initio centroid molecular dynamics
    COMPUTER PHYSICS COMMUNICATIONS
    
    D. Marx et al., "Quantum dynamics via adiabatic ab initio centroid molecular dynamics", COMP PHYS C, 118(2-3), 1999, pp. 166-184
19. BANDYOPADHYAY S; KLEIN ML; MARTYNA GJ; TAREK M
    MOLECULAR-DYNAMICS STUDIES OF THE HEXAGONAL MESOPHASE OF SODIUM DODECYL-SULFATE IN AQUEOUS-SOLUTION
    Molecular physics (Print)
    
    S. Bandyopadhyay et al., "MOLECULAR-DYNAMICS STUDIES OF THE HEXAGONAL MESOPHASE OF SODIUM DODECYL-SULFATE IN AQUEOUS-SOLUTION", Molecular physics (Print), 95(2), 1998, pp. 377-384
20. PROCACCI P; MARCHI M; MARTYNA GJ
    ELECTROSTATIC CALCULATIONS AND MULTIPLE TIME SCALES IN MOLECULAR-DYNAMICS SIMULATION OF FLEXIBLE MOLECULAR-SYSTEMS
    The Journal of chemical physics
    
    P. Procacci et al., "ELECTROSTATIC CALCULATIONS AND MULTIPLE TIME SCALES IN MOLECULAR-DYNAMICS SIMULATION OF FLEXIBLE MOLECULAR-SYSTEMS", The Journal of chemical physics, 108(21), 1998, pp. 8799-8803
21. Samuelson, SO; Martyna, GJ
    Two dimensional umbrella sampling techniques for the computer simulation study of helical peptides at thermal equilibrium: The 3K(I) peptide in vacuoand solution
    JOURNAL OF CHEMICAL PHYSICS
    
    S.O. Samuelson e G.J. Martyna, "Two dimensional umbrella sampling techniques for the computer simulation study of helical peptides at thermal equilibrium: The 3K(I) peptide in vacuoand solution", J CHEM PHYS, 109(24), 1998, pp. 11061-11073
22. SAMUELSON S; TOBIAS DJ; MARTYNA GJ
    MODERN COMPUTATIONAL METHODOLOGY APPLIED TO THE SIMULATION OF BLOCKEDTRIALANINE PEPTIDE IN-VACUO, WATER CLUSTERS, AND BULK WATER
    JOURNAL OF PHYSICAL CHEMISTRY B
    
    S. Samuelson et al., "MODERN COMPUTATIONAL METHODOLOGY APPLIED TO THE SIMULATION OF BLOCKEDTRIALANINE PEPTIDE IN-VACUO, WATER CLUSTERS, AND BULK WATER", JOURNAL OF PHYSICAL CHEMISTRY B, 101(38), 1997, pp. 7592-7603
23. SAMUELSON S; HUGHES A; MARTYNA GJ
    SOLVENT, FORCE-FIELD, TEMPERATURE AND QUANTUM EFFECTS ON THE FOLDING FREE-ENERGY SURFACE OF BLOCKED ALANINE TRIPEPTIDE
    Journal de chimie physique et de physico-chimie biologique
    
    S. Samuelson et al., "SOLVENT, FORCE-FIELD, TEMPERATURE AND QUANTUM EFFECTS ON THE FOLDING FREE-ENERGY SURFACE OF BLOCKED ALANINE TRIPEPTIDE", Journal de chimie physique et de physico-chimie biologique, 94(7-8), 1997, pp. 1503-1531
24. MARTYNA GJ; TUCKERMAN ME; TOBIAS DJ; KLEIN ML
    EXPLICIT REVERSIBLE INTEGRATORS FOR EXTENDED SYSTEMS DYNAMICS
    Molecular physics
    
    G.J. Martyna et al., "EXPLICIT REVERSIBLE INTEGRATORS FOR EXTENDED SYSTEMS DYNAMICS", Molecular physics, 87(5), 1996, pp. 1117-1157
25. MARTYNA GJ
    ADIABATIC PATH-INTEGRAL MOLECULAR-DYNAMICS METHODS .1. THEORY
    The Journal of chemical physics
    
    G.J. Martyna, "ADIABATIC PATH-INTEGRAL MOLECULAR-DYNAMICS METHODS .1. THEORY", The Journal of chemical physics, 104(5), 1996, pp. 2018-2027
26. CAO J; MARTYNA GJ
    ADIABATIC PATH-INTEGRAL MOLECULAR-DYNAMICS METHODS .2. ALGORITHMS
    The Journal of chemical physics
    
    J. Cao e G.J. Martyna, "ADIABATIC PATH-INTEGRAL MOLECULAR-DYNAMICS METHODS .2. ALGORITHMS", The Journal of chemical physics, 104(5), 1996, pp. 2028-2035
27. MARTYNA GJ; TUCKERMAN ME
    SYMPLECTIC REVERSIBLE INTEGRATORS - PREDICTOR CORRECTOR METHODS
    The Journal of chemical physics
    
    G.J. Martyna e M.E. Tuckerman, "SYMPLECTIC REVERSIBLE INTEGRATORS - PREDICTOR CORRECTOR METHODS", The Journal of chemical physics, 102(20), 1995, pp. 8071-8077
28. MARTYNA GJ
    REMARKS ON CONSTANT-TEMPERATURE MOLECULAR-DYNAMICS WITH MOMENTUM CONSERVATION
    Physical review. E, Statistical physics, plasmas, fluids, and related interdisciplinary topics
    
    G.J. Martyna, "REMARKS ON CONSTANT-TEMPERATURE MOLECULAR-DYNAMICS WITH MOMENTUM CONSERVATION", Physical review. E, Statistical physics, plasmas, fluids, and related interdisciplinary topics, 50(4), 1994, pp. 3234-3236
29. MARTYNA GJ
    REMARKS ON CONSTANT-TEMPERATURE MOLECULAR-DYNAMICS WITH MOMENTUM CONSERVATION
    Physical review. E, Statistical physics, plasmas, fluids, and related interdisciplinary topics
    
    G.J. Martyna, "REMARKS ON CONSTANT-TEMPERATURE MOLECULAR-DYNAMICS WITH MOMENTUM CONSERVATION", Physical review. E, Statistical physics, plasmas, fluids, and related interdisciplinary topics, 50(4), 1994, pp. 3234-3236
30. DENG ZH; KLEIN ML; MARTYNA GJ
    ELECTRONIC STATES AND THE METAL-INSULATOR-TRANSITION IN CESIUM AMMONIA SOLUTIONS
    Journal of the Chemical Society. Faraday transactions
    
    Z.H. Deng et al., "ELECTRONIC STATES AND THE METAL-INSULATOR-TRANSITION IN CESIUM AMMONIA SOLUTIONS", Journal of the Chemical Society. Faraday transactions, 90(14), 1994, pp. 2009-2013
31. MARTYNA GJ; TOBIAS DJ; KLEIN ML
    CONSTANT-PRESSURE MOLECULAR-DYNAMICS ALGORITHMS
    The Journal of chemical physics
    
    G.J. Martyna et al., "CONSTANT-PRESSURE MOLECULAR-DYNAMICS ALGORITHMS", The Journal of chemical physics, 101(5), 1994, pp. 4177-4189
32. DENG ZH; MARTYNA GJ; KLEIN ML
    QUANTUM SIMULATION STUDIES OF METAL-AMMONIA SOLUTIONS
    The Journal of chemical physics
    
    Z.H. Deng et al., "QUANTUM SIMULATION STUDIES OF METAL-AMMONIA SOLUTIONS", The Journal of chemical physics, 100(10), 1994, pp. 7590-7601
33. SCHARF D; MARTYNA GJ; KLEIN ML
    STRUCTURE AND ENERGETICS OF FLUID PARA-HYDROGEN
    Fizika nizkih temperatur
    
    D. Scharf et al., "STRUCTURE AND ENERGETICS OF FLUID PARA-HYDROGEN", Fizika nizkih temperatur, 19(5), 1993, pp. 516-519
34. DENG ZH; MARTYNA GJ; KLEIN ML
    ELECTRONIC STATES IN METAL-AMMONIA SOLUTIONS
    Physical review letters
    
    Z.H. Deng et al., "ELECTRONIC STATES IN METAL-AMMONIA SOLUTIONS", Physical review letters, 71(2), 1993, pp. 267-270
35. TOBIAS DJ; MARTYNA GJ; KLEIN ML
    MOLECULAR-DYNAMICS SIMULATIONS OF A PROTEIN IN THE CANONICAL ENSEMBLE
    Journal of physical chemistry
    
    D.J. Tobias et al., "MOLECULAR-DYNAMICS SIMULATIONS OF A PROTEIN IN THE CANONICAL ENSEMBLE", Journal of physical chemistry, 97(49), 1993, pp. 12959-12966
36. TUCKERMAN ME; BERNE BJ; MARTYNA GJ; KLEIN ML
    EFFICIENT MOLECULAR-DYNAMICS AND HYBRID MONTE-CARLO ALGORITHMS FOR PATH-INTEGRALS
    The Journal of chemical physics
    
    M.E. Tuckerman et al., "EFFICIENT MOLECULAR-DYNAMICS AND HYBRID MONTE-CARLO ALGORITHMS FOR PATH-INTEGRALS", The Journal of chemical physics, 99(4), 1993, pp. 2796-2808
37. TUCKERMAN M; BERNE BJ; MARTYNA GJ
    REVERSIBLE MULTIPLE TIME-SCALE MOLECULAR-DYNAMICS - REPLY
    The Journal of chemical physics
    
    M. Tuckerman et al., "REVERSIBLE MULTIPLE TIME-SCALE MOLECULAR-DYNAMICS - REPLY", The Journal of chemical physics, 99(3), 1993, pp. 2278-2279
38. SCHARF D; MARTYNA GJ; KLEIN ML
    PATH-INTEGRAL MONTE-CARLO STUDY OF A LITHIUM IMPURITY IN PARA-HYDROGEN - CLUSTERS AND THE BULK LIQUID
    The Journal of chemical physics
    
    D. Scharf et al., "PATH-INTEGRAL MONTE-CARLO STUDY OF A LITHIUM IMPURITY IN PARA-HYDROGEN - CLUSTERS AND THE BULK LIQUID", The Journal of chemical physics, 99(11), 1993, pp. 8997-9012
39. SCHARF D; MARTYNA GJ; LI DH; VOTH GA; KLEIN ML
    NATURE OF LITHIUM TRAPPING SITES IN THE QUANTUM SOLIDS PARA-HYDROGEN AND ORTHO-DEUTERIUM
    The Journal of chemical physics
    
    D. Scharf et al., "NATURE OF LITHIUM TRAPPING SITES IN THE QUANTUM SOLIDS PARA-HYDROGEN AND ORTHO-DEUTERIUM", The Journal of chemical physics, 99(11), 1993, pp. 9013-9020