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A united-residue force field for off-lattice protein-structure simulations. I. Functional forms and parameters of long-range side-chain interaction potentials from protein crystal data.

A. Liwo, S. Oldziej, M. Pincus, R. Wawak, S. Rackovsky, and H. Scheraga. J. Comput. Chem., 18 (7): 849-873 (1997)

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Harold Rüdiger

Harold Green

Harold Konschegg

Harold Yorke

Harold Schreiber

Other publications of authors with the same name

A new protein nucleic-acid coarse-grained force field based on the UNRES and NARES-2P force fields.A. Sieradzan, A. Gieldon, Y. Yin, Y. He, H. Scheraga, and A. Liwo. J. Comput. Chem., 39 (28): 2360-2370 (2018)Correction to Maximum Likelihood Calibration of the UNRES Force Field for Simulation of Protein Structure and Dynamics.P. Krupa, A. Halabis, W. Zmudzinska, S. Oldziej, H. Scheraga, and A. Liwo. J. Chem. Inf. Model., 58 (1): 206 (2018)Performance of protein-structure predictions with the physics-based UNRES force field in CASP11.P. Krupa, M. Mozolewska, M. Wisniewska, Y. Yin, Y. He, A. Sieradzan, R. Ganzynkowicz, A. Lipska, A. Karczynska, M. Slusarz and 7 other author(s). Bioinform., 32 (21): 3270-3278 (2016)B-spline method for energy minimization in grid-based molecular mechanics calculations.D. Oberlin, and H. Scheraga. J. Comput. Chem., 19 (1): 71-85 (1998)Determination of net atomic charges using a modified partial equalization of orbital electronegativity method. III. Application to halogenated and aromatic molecules.J. Park, K. No, M. Jhon, and H. Scheraga. J. Comput. Chem., 14 (12): 1482-1490 (1993)Influence of temperature, friction, and random forces on folding of the B-domain of staphylococcal protein A: All-atom molecular dynamics in implicit solvent.A. Jagielska, and H. Scheraga. J. Comput. Chem., 28 (6): 1068-1082 (2007)Surmounting the Multiple-Minima Problem in Protein Folding.H. Scheraga, J. Lee, J. Pillardy, Y. Ye, A. Liwo, and D. Ripoll. J. Glob. Optim., 15 (3): 235-260 (1999)Coarse-grained model of nucleic acid bases.M. Maciejczyk, A. Spasic, A. Liwo, and H. Scheraga. J. Comput. Chem., 31 (8): 1644-1655 (2010)An assessment of the accuracy of the RRIGS hydration potential: Comparison to solutions of the Poisson-Boltzmann equation.J. Augspurger, and H. Scheraga. J. Comput. Chem., 18 (8): 1072-1078 (1997)Are accurate computations of the 13C′ shielding feasible at the DFT level of theory?J. Vila, Y. Arnautova, O. Martin, and H. Scheraga. J. Comput. Chem., 35 (4): 309-312 (2014)

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Disambiguation of "Scheraga, Harold A."