Blue matter: Scaling of N-body simulations to one atom per node
- Blake G. Fitch
- Aleksandr Rayshubskiy
- et al.
- 2008
- IBM J. Res. Dev
Review
Publications
56 results for William C. Swope
Interfacial fluctuations of block copolymers: A coarse-grain molecular dynamics simulation study
- Goundla Srinivas
- William C. Swope
- et al.
- 2007
- Journal of Physical Chemistry B
PaperAutomatic discovery of metastable states for the construction of Markov models of macromolecular conformational dynamics
- John D. Chodera
- Nina Singhal
- et al.
- 2007
- Journal of Chemical Physics
PaperLong-time protein folding dynamics from short-time molecular dynamics simulations
- John D. Chodera
- William C. Swope
- et al.
- 2006
- Multiscale Modeling and Simulation
PaperUse of the weighted histogram analysis method for the analysis of simulated and parallel tempering simulations
- John D. Chodera
- William C. Swope
- et al.
- 2006
- JCTC
PaperAbsence of reptation in the high-temperature folding of the trpzip2 Β -hairpin peptide
- Jed W. Pitera
- Imran Haque
- et al.
- 2006
- Journal of Chemical Physics
PaperCorrelation of early orientational ordering of engineered λ6-85 structure with kinetics and thermodynamics
- Edgar Larios
- Jed W. Pitera
- et al.
- 2006
- Chemical Physics
PaperKinetic computational alanine scanning: Application to p53 oligomerization
- Lillian T. Chong
- William C. Swope
- et al.
- 2006
- Journal of Molecular Biology
PaperCharacterization of the TIP4P-Ew water model: Vapor pressure and boiling point
- Hans W. Horn
- William C. Swope
- et al.
- 2005
- Journal of Chemical Physics
PaperOverview of molecular dynamics techniques and early scientific results from the Blue Gene project
- Frank Suits
- Michael C. Pitman
- et al.
- 2005
- IBM J. Res. Dev
Paper