| VMD: visual molecular dynamics W Humphrey, A Dalke, K Schulten Journal of molecular graphics 14 (1), 33-38, 1996 | 49440 | 1996 |
| Scalable molecular dynamics with NAMD JC Phillips, R Braun, W Wang, J Gumbart, E Tajkhorshid, E Villa, C Chipot, ... Journal of computational chemistry 26 (16), 1781-1802, 2005 | 17455 | 2005 |
| NAMD2: greater scalability for parallel molecular dynamics L Kalé, R Skeel, M Bhandarkar, R Brunner, A Gursoy, N Krawetz, ... Journal of Computational Physics 151 (1), 283-312, 1999 | 2875 | 1999 |
| Molecular biomimetics: nanotechnology through biology M Sarikaya, C Tamerler, AKY Jen, K Schulten, F Baneyx Nature materials 2 (9), 577-585, 2003 | 1948 | 2003 |
| 'Neural-gas' network for vector quantization and its application to time-series prediction TM Martinetz, SG Berkovich, KJ Schulten IEEE transactions on neural networks 4 (4), 558-569, 1993 | 1915 | 1993 |
| The crystal structure of the light-harvesting complex II (B800–850) from Rhodospirillum molischianum J Koepke, X Hu, C Muenke, K Schulten, H Michel Structure 4 (5), 581-597, 1996 | 1302 | 1996 |
| A model for photoreceptor-based magnetoreception in birds T Ritz, S Adem, K Schulten Biophysical journal 78 (2), 707-718, 2000 | 1246 | 2000 |
| A" neural-gas" network learns topologies T Martinetz, K Schulten University of Illinois at Urbana-Champaign 1 (01), 1991 | 1244 | 1991 |
| Neural computation and self-organizing maps: an introduction H Ritter, T Martinetz, K Schulten Addison-Wesley, 1992 | 1211 | 1992 |
| Topology representing networks T Martinetz, K Schulten Neural Networks 7 (3), 507-522, 1994 | 1167 | 1994 |
| Steered molecular dynamics and mechanical functions of proteins B Isralewitz, M Gao, K Schulten Current opinion in structural biology 11 (2), 224-230, 2001 | 1115 | 2001 |
| Scalable molecular dynamics on CPU and GPU architectures with NAMD JC Phillips, DJ Hardy, JDC Maia, JE Stone, JV Ribeiro, RC Bernardi, ... The Journal of chemical physics 153 (4), 044130, 2020 | 1103 | 2020 |
| Control of the selectivity of the aquaporin water channel family by global orientational tuning E Tajkhorshid, P Nollert, MØ Jensen, LJW Miercke, J O'Connell, ... Science 296 (5567), 525-530, 2002 | 1049 | 2002 |
| Mechanical unfolding intermediates in titin modules PE Marszalek, H Lu, H Li, M Carrion-Vazquez, AF Oberhauser, ... Nature 402 (6757), 100-103, 1999 | 936 | 1999 |
| Accelerating molecular modeling applications with graphics processors JE Stone, JC Phillips, PL Freddolino, DJ Hardy, LG Trabuco, K Schulten Journal of computational chemistry 28 (16), 2618-2640, 2007 | 908 | 2007 |
| Calculating potentials of mean force from steered molecular dynamics simulations S Park, K Schulten The Journal of chemical physics 120 (13), 5946-5961, 2004 | 904 | 2004 |
| Molecular dynamics study of unbinding of the avidin-biotin complex S Izrailev, S Stepaniants, M Balsera, Y Oono, K Schulten Biophysical journal 72 (4), 1568-1581, 1997 | 895 | 1997 |
| First passage time approach to diffusion controlled reactions A Szabo, K Schulten, Z Schulten The Journal of chemical physics 72 (8), 4350-4357, 1980 | 895 | 1980 |
| Flexible fitting of atomic structures into electron microscopy maps using molecular dynamics LG Trabuco, E Villa, K Mitra, J Frank, K Schulten Structure 16 (5), 673-683, 2008 | 876 | 2008 |
| Free energy calculation from steered molecular dynamics simulations using Jarzynski’s equality S Park, F Khalili-Araghi, E Tajkhorshid, K Schulten The Journal of chemical physics 119 (6), 3559-3566, 2003 | 845 | 2003 |
