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William Smith
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DL_POLY_2. 0: A general-purpose parallel molecular dynamics simulation package
W Smith, TR Forester
Journal of molecular graphics 14 (3), 136-141, 1996
25771996
DL_POLY_3: new dimensions in molecular dynamics simulations via massive parallelism
IT Todorov, W Smith, K Trachenko, MT Dove
Journal of Materials Chemistry 16 (20), 1911-1918, 2006
13062006
Chemical reaction equilibrium analysis
WR Smith
Theory and Algorithms, 1982
12661982
DL_POLY: Application to molecular simulation
W Smith, CW Yong, PM Rodger
Molecular Simulation 28 (5), 385-471, 2002
7082002
AMBER 14; University of California: San Francisco, 2014
DA Case, V Babin, JT Berryman, RM Betz, Q Cai, DS Cerutti, ...
There is no corresponding record for this reference, 1-826, 2014
4642014
Gender differences in risk perception and neutralizing fear of crime: Toward resolving the paradoxes
WR Smith, M Torstensson
The British Journal of Criminology 37 (4), 608-634, 1997
4141997
The DL poly 2 user manual
W Smith, TR Forester, IT Todorov, M Leslie
CCLRC, Daresbury Laboratory, Daresbury, Warrington WA4 4AD, England 2, 2006
3612006
Analytical representation of the Percus-Yevick hard-sphere radial distribution function
WR Smith, D Henderson
Molecular Physics 19 (3), 411-415, 1970
3191970
The reaction ensemble method for the computer simulation of chemical and phase equilibria. I. Theory and basic examples
WR Smith, B Triska
The Journal of chemical physics 100 (4), 3019-3027, 1994
2701994
Simulations of the methane hydrate/methane gas interface near hydrate forming conditions conditions
PM Rodger, TR Forester, W Smith
Fluid phase equilibria 116 (1-2), 326-332, 1996
2631996
AMBER 2018. University of California, San Francisco (2018)
DA Case, JT Berryman, RM Betz, DS Cerutti, TE Cheatham III, TA Darden, ...
There is no corresponding record for this reference, 2015
2622015
A short description of DL_POLY
W Smith, IT Todorov
Molecular Simulation 32 (12-13), 935-943, 2006
2442006
Molecular dynamics on hypercube parallel computers
W Smith
Computer Physics Communications 62 (2-3), 229-248, 1991
2011991
Canada’s program on nuclear hydrogen production and the thermochemical Cu–Cl cycle
GF Naterer, S Suppiah, L Stolberg, M Lewis, Z Wang, V Daggupati, ...
international journal of hydrogen energy 35 (20), 10905-10926, 2010
1832010
DL_MESO: highly scalable mesoscale simulations
MA Seaton, RL Anderson, S Metz, W Smith
Molecular Simulation 39 (10), 796-821, 2013
1822013
Guest Editorial: DL_POLY–applications to molecular simulation II
W Smith
Taylor & Francis Group 32 (12-13), 933-933, 2006
1802006
Robotic cholecystectomy: learning curve, advantages, and limitations
TJ Vidovszky, W Smith, J Ghosh, MR Ali
Journal of Surgical Research 136 (2), 172-178, 2006
1702006
SHAKE, rattle, and roll: efficient constraint algorithms for linked rigid bodies
TR Forester, W Smith
Journal of computational chemistry 19 (1), 102-111, 1998
1651998
Molecular dynamics calculation of elastic constants in Gay–Berne nematic liquid crystals
MP Allen, MA Warren, MR Wilson, A Sauron, W Smith
The Journal of chemical physics 105 (7), 2850-2858, 1996
1621996
Extremal arrangements of points and unit charges on a sphere: equilibrium configurations revisited
TW Melnyk, O Knop, WR Smith
Canadian Journal of Chemistry 55 (10), 1745-1761, 1977
1571977
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Artikler 1–20