| VMD: visual molecular dynamics W Humphrey, A Dalke, K Schulten Journal of molecular graphics 14 (1), 33-38, 1996 | 53865 | 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 | 18073 | 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 | 2941 | 1999 |
| Molecular biomimetics: nanotechnology through biology M Sarikaya, C Tamerler, AKY Jen, K Schulten, F Baneyx Nature materials 2 (9), 577-585, 2003 | 1984 | 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 | 1956 | 1993 |
| 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), 2020 | 1546 | 2020 |
| 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 | 1322 | 1996 |
| A model for photoreceptor-based magnetoreception in birds T Ritz, S Adem, K Schulten Biophysical journal 78 (2), 707-718, 2000 | 1314 | 2000 |
| Neural computation and self-organizing maps: an introduction H Ritter, T Martinetz, K Schulten Addison-Wesley, 1992 | 1290 | 1992 |
| A" neural-gas" network learns topologies T Martinetz, K Schulten University of Illinois at Urbana-Champaign 1 (01), 1991 | 1272 | 1991 |
| Topology representing networks T Martinetz, K Schulten Neural Networks 7 (3), 507-522, 1994 | 1190 | 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 | 1171 | 2001 |
| 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 | 1080 | 2002 |
| Calculating potentials of mean force from steered molecular dynamics simulations S Park, K Schulten The Journal of chemical physics 120 (13), 5946-5961, 2004 | 947 | 2004 |
| Mechanical unfolding intermediates in titin modules PE Marszalek, H Lu, H Li, M Carrion-Vazquez, AF Oberhauser, ... Nature 402 (6757), 100-103, 1999 | 944 | 1999 |
| 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 | 925 | 1997 |
| 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 | 922 | 2008 |
| 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 | 921 | 2007 |
| First passage time approach to diffusion controlled reactions A Szabo, K Schulten, Z Schulten The Journal of chemical physics 72 (8), 4350-4357, 1980 | 915 | 1980 |
| Mature HIV-1 capsid structure by cryo-electron microscopy and all-atom molecular dynamics G Zhao, JR Perilla, EL Yufenyuy, X Meng, B Chen, J Ning, J Ahn, ... Nature 497 (7451), 643-646, 2013 | 889 | 2013 |
