Gaussian 03 rev. E. 01 MJ Frisch http://www. gaussian. com/, 2004 | 38710 | 2004 |
Gaussian Inc MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Wallingford Ct 2009, 2009 | 35984* | 2009 |
Gaussian 16 MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Gaussian, Inc., 2016 | 26037* | 2016 |
Gaussian 98, revision a. 7, Gaussian MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Inc., Pittsburgh, PA 12, 1998 | 19289 | 1998 |
A second generation force field for the simulation of proteins, nucleic acids, and organic molecules WD Cornell, P Cieplak, CI Bayly, IR Gould, KM Merz, DM Ferguson, ... Journal of the American Chemical Society 117 (19), 5179-5197, 1995 | 16449 | 1995 |
The Amber biomolecular simulation programs DA Case, TE Cheatham III, T Darden, H Gohlke, R Luo, KM Merz Jr, ... Journal of computational chemistry 26 (16), 1668-1688, 2005 | 10091 | 2005 |
The Amber biomolecular simulation programs DA Case, TE Cheatham III, T Darden, H Gohlke, R Luo, KM Merz Jr, ... Journal of computational chemistry 26 (16), 1668-1688, 2005 | 10091 | 2005 |
Amber 10 DA Case, TA Darden, TE Cheatham, CL Simmerling, J Wang, RE Duke, ... University of California, 2008 | 9009 | 2008 |
AMBER 21 DA Case, J Berryman, RM Betz, DS Cerutti, TE Cheatham Iii, TA Darden, ... University of California, 2021 | 5788* | 2021 |
Atomic charges derived from semiempirical methods BH Bessler, KM Merz Jr, PA Kollman J. Comput. Chem 11 (4), 431-439, 1990 | 3845 | 1990 |
AMBER 9 DA Case, TA Darden, TE Cheatham III, CL Simmerling, J Wang, RE Duke, ... University of California, San Francisco 45, 2006 | 3471 | 2006 |
Prediction of drug absorption using multivariate statistics WJ Egan, KM Merz, JJ Baldwin Journal of medicinal chemistry 43 (21), 3867-3877, 2000 | 1836 | 2000 |
Rational design of particle mesh Ewald compatible Lennard-Jones parameters for+ 2 metal cations in explicit solvent P Li, BP Roberts, DK Chakravorty, KM Merz Jr Journal of chemical theory and computation 9 (6), 2733-2748, 2013 | 727 | 2013 |
Gaussian, Inc., Wallingford CT MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Gaussian 09 (Revision A. 02), 2009 | 619 | 2009 |
MCPB. py: A python based metal center parameter builder P Li, KM Merz Jr Journal of chemical information and modeling 56 (4), 599-604, 2016 | 570 | 2016 |
AMBER 10; University of California: San Francisco, 2008 DA Case, TA Darden, TE Cheatham III, CL Simmerling, J Wang, RE Duke, ... Google Scholar There is no corresponding record for this reference, 2008 | 508 | 2008 |
AMBER 9; University of California: San Francisco, 2006 DA Case, TA Darden, TE Cheatham III, CL Simmerling, J Wang, RE Duke, ... There is no corresponding record for this reference.[Google Scholar], 9-174, 2014 | 498 | 2014 |
Structural survey of zinc-containing proteins and development of the zinc AMBER force field (ZAFF) MB Peters, Y Yang, B Wang, L Fusti-Molnar, MN Weaver, KM Merz Jr Journal of chemical theory and computation 6 (9), 2935-2947, 2010 | 490 | 2010 |
AmberTools DA Case, HM Aktulga, K Belfon, DS Cerutti, GA Cisneros, VWD Cruzeiro, ... Journal of chemical information and modeling 63 (20), 6183-6191, 2023 | 460 | 2023 |
Combined quantum mechanical/molecular mechanical methodologies applied to biomolecular systems G Monard, KM Merz Accounts of chemical research 32 (10), 904-911, 1999 | 429 | 1999 |