A Kirkwood− Buff derived force field for mixtures of urea and water S Weerasinghe, PE Smith The Journal of Physical Chemistry B 107 (16), 3891-3898, 2003 | 277 | 2003 |
A Kirkwood–Buff derived force field for sodium chloride in water S Weerasinghe, PE Smith The Journal of chemical physics 119 (21), 11342-11349, 2003 | 244 | 2003 |
Recent applications of Kirkwood–Buff theory to biological systems V Pierce, M Kang, M Aburi, S Weerasinghe, PE Smith Cell biochemistry and biophysics 50, 1-22, 2008 | 225 | 2008 |
Absolute classical densities of states for very anharmonic systems and applications to the evaporation of rare gas clusters S Weerasinghe, FG Amar The Journal of chemical physics 98 (6), 4967-4983, 1993 | 172 | 1993 |
A Kirkwood-Buff derived force field for aqueous alkali halides MB Gee, NR Cox, Y Jiao, N Bentenitis, S Weerasinghe, PE Smith Journal of chemical theory and computation 7 (5), 1369-1380, 2011 | 162 | 2011 |
Kirkwood–Buff derived force field for mixtures of acetone and water S Weerasinghe, PE Smith The Journal of chemical physics 118 (23), 10663-10670, 2003 | 157 | 2003 |
A Kirkwood− Buff derived force field for methanol and aqueous methanol solutions S Weerasinghe, PE Smith The Journal of Physical Chemistry B 109 (31), 15080-15086, 2005 | 136 | 2005 |
Nanosecond dynamics and structure of a model DNA triple helix in saltwater solution S Weerasinghe, PE Smith, V Mohan, YK Cheng, BM Pettitt Journal of the American Chemical Society 117 (8), 2147-2158, 1995 | 102 | 1995 |
Dielectric response of triplex DNA in ionic solution from simulations L Yang, S Weerasinghe, PE Smith, BM Pettitt Biophysical journal 69 (4), 1519-1527, 1995 | 96 | 1995 |
A Kirkwood-Buff derived force field for the simulation of aqueous guanidinium chloride solutions S Weerasinghe, PE Smith The Journal of chemical physics 121 (5), 2180-2186, 2004 | 90 | 2004 |
Ideal chemical potential contribution in molecular dynamics simulations of the grand canonical ensemble S Weerasinghe, BM Pettitt Molecular Physics 82 (5), 897-912, 1994 | 59 | 1994 |
Cavity formation and preferential interactions in urea solutions: Dependence on urea aggregation S Weerasinghe, PE Smith The Journal of chemical physics 118 (13), 5901-5910, 2003 | 56 | 2003 |
Structure and stability of a model pyrimidine-purine-purine DNA triple helix with a GC. cntdot. T mismatch by simulation S Weerasinghe, PE Smith, BM Pettitt Biochemistry 34 (50), 16269-16278, 1995 | 37 | 1995 |
Is cluster evaporation statistical? A comparison of simulation results for Ar13 with exact classical phase space theory S Weerasinghe, FG Amar Zeitschrift für Physik D Atoms, Molecules and Clusters 20, 167-171, 1991 | 35 | 1991 |
Determination of heavy metals in tilapia using various digestion methods P Ranasinghe, S Weerasinghe, MN Kaumal Int J Sci Res Inno Technol 3, 38-48, 2016 | 30 | 2016 |
Theory and simulation of multicomponent osmotic systems S Karunaweera, MB Gee, S Weerasinghe, PE Smith Journal of chemical theory and computation 8 (10), 3493-3503, 2012 | 27 | 2012 |
Characterization of a Bacillus megaterium strain with metal bioremediation potential and in silico discovery of novel cadmium binding motifs in the regulator, CadC CW Nilmini Kumari, Shalini Thiruchittampalam, Samantha Weerasinghe Applied Microbiology and Biotechnology 105, 2573-2586, 2021 | 24 | 2021 |
Development of a molecular mechanics force field for caffeine to investigate the interactions of caffeine in different solvent media R Sanjeewa, S Weerasinghe Journal of Molecular Structure: THEOCHEM 944 (1-3), 116-123, 2010 | 23 | 2010 |
Study of aggregate formation of caffeine in water by molecular dynamics simulation R Sanjeewa, S Weerasinghe Computational and Theoretical Chemistry 966 (1-3), 140-148, 2011 | 21 | 2011 |
Developing force fields from the microscopic structure of solutions: The Kirkwood–Buff approach S Weerasinghe, MB Gee, M Kang, N Bentenitis, PE Smith Modeling solVent enVironments: applications to simulations of biomolecules …, 2010 | 21 | 2010 |