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Results: 1-3 |
Results: 3
Comparison of linear-scaling semiempirical methods and combined quantum mechanical/molecular mechanical methods applied to enzyme reactions
Authors: Titmuss, SJ Cummins, PL Bliznyuk, AA Rendell, AP Gready, JE
Citation: Sj. Titmuss et al., Comparison of linear-scaling semiempirical methods and combined quantum mechanical/molecular mechanical methods applied to enzyme reactions, CHEM P LETT, 320(1-2), 2000, pp. 169-176
Simple method for locating possible ligand binding sites on protein surfaces
Authors: Bliznyuk, AA Gready, JE
Citation: Aa. Bliznyuk et Je. Gready, Simple method for locating possible ligand binding sites on protein surfaces, J COMPUT CH, 20(9), 1999, pp. 983-988
Faster gradients for semiempirical methods
Authors: Bliznyuk, AA Rendell, AP
Citation: Aa. Bliznyuk et Ap. Rendell, Faster gradients for semiempirical methods, J COMPUT CH, 20(6), 1999, pp. 629-635
Risultati: 1-3 |