| 2009 |
|---|
| 5 | EE | Maik Goette,
Helmut Grubmüller:
Accuracy and convergence of free energy differences calculated from nonequilibrium switching processes.
Journal of Computational Chemistry 30(3): 447-456 (2009) |
| 2007 |
|---|
| 4 | EE | Carsten Kutzner,
David van der Spoel,
Martin Fechner,
Erik Lindahl,
Udo W. Schmitt,
Bert L. de Groot,
Helmut Grubmüller:
Speeding up parallel GROMACS on high-latency networks.
Journal of Computational Chemistry 28(12): 2075-2084 (2007) |
| 2006 |
|---|
| 3 | EE | Carsten Kutzner,
David van der Spoel,
Martin Fechner,
Erik Lindahl,
Udo W. Schmitt,
Bert L. de Groot,
Helmut Grubmüller:
Improved GROMACS Scaling on Ethernet Switched Clusters.
PVM/MPI 2006: 404-405 |
| 2 | EE | Oliver F. Lange,
Lars V. Schäfer,
Helmut Grubmüller:
Flooding in GROMACS: Accelerated barrier crossings in molecular dynamics.
Journal of Computational Chemistry 27(14): 1693-1702 (2006) |
| 1998 |
|---|
| 1 | EE | Helmut Grubmüller,
Paul Tavan:
Multiple time step algorithms for molecular dynamics simulations of proteins: How good are they?
Journal of Computational Chemistry 19(13): 1534-1552 (1998) |
