The DOI matches its Crossref record; 8 of the 8 references it cites were found in a registry or an index.
A consistent empirical potential for water–protein interactions
Abstract
A simple point‐charge potential, developed earlier for the calculation of intermolecular forces in molecular‐dynamics simulations of liquid water, has been extended to include interactions between water molecules and polar groups of proteins. A complete potential for use in the simulation of protein dynamics in water is reported.
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Citations
Cites
Interaction Models for Water in Relation to Protein Hydration
Berendsen, H. J. C., Postma, J. P. M., van Gunsteren, W. F., & Hermans, J. (1981) · The Jerusalem Symposia on Quantum Chemistry and Biochemistry · doi:10.1007/978-94-015-7658-1_21 · Cited by 5,654
Self-citationImproved simulation of liquid water by molecular dynamics
Stillinger, F. H., & Rahman, A. (1974) · The Journal of Chemical Physics · doi:10.1063/1.1681229 · Cited by 1,687
Jorgensen, W. L. (1981) · Journal of the American Chemical Society · doi:10.1021/ja00392a016 · Cited by 1,294
Lifson, S., Hagler, A. T., & Dauber, P. (1979) · Journal of the American Chemical Society · doi:10.1021/ja00512a001 · Cited by 509
Hagler, A. T., Lifson, S., & Dauber, P. (1979) · Journal of the American Chemical Society · doi:10.1021/ja00512a002 · Cited by 488
Side-chain torsional potentials: effect of dipeptide, protein, and solvent environment
Gelin, B. R., & Karplus, M. (1979) · Biochemistry · doi:10.1021/bi00574a022 · Cited by 293
Computer simulation of the dynamics of hydrated protein crystals and its comparison with x-ray data.
van Gunsteren, W. F., Berendsen, H. J. C., Hermans, J., Hol, W. G. J., & Postma, J. P. M. (1983) · Proceedings of the National Academy of Sciences · doi:10.1073/pnas.80.14.4315 · Cited by 229
Self-citationDunfield, L. G., Burgess, A. W., & Scheraga, H. A. (1978) · The Journal of Physical Chemistry · doi:10.1021/j100513a014 · Cited by 181
Cited by
Soares, C. M., Teixeira, V. H., & Baptista, A. M. (2003) · Biophysical Journal · doi:10.1016/s0006-3495(03)74972-8 · Cited by 149
Challenges in the computational design of proteins
Suárez, M., & Jaramillo, A. (2009) · Journal of The Royal Society Interface · doi:10.1098/rsif.2008.0508.focus · Cited by 59
Jahanban-Esfahlan, R., Seidi, K., Monhemi, H., Adli, A. D. F., Minofar, B., Zare, P., Farajzadeh, D., Farajnia, S., Behzadi, R., Abbasi, M. M., et al. (2017) · Scientific Reports · doi:10.1038/s41598-017-05326-9 · Cited by 58
Bostick, D. L., & Brooks, C. L. (2009) · Biophysical Journal · doi:10.1016/j.bpj.2009.03.001 · Cited by 26
Computational Approaches to Zeolite-Based Adsorption Processes
Gutiérrez-Sevillano, J. J., & Calero, S. (2020) · Structure and Bonding · doi:10.1007/430_2020_66 · Cited by 4
Metadata
- Authors
- Hermans, J., Berendsen, H. J. C., Van Gunsteren, W. F., & Postma, J. P. M.
- Venue
- Biopolymers
- Publisher
- Wiley
- Published
- 1984-08
- Volume
- 23
- Issue
- 8
- Pages
- 1513-1518
- ISSN
- 0006-3525 (ISSN-L)
- 1097-0282
- OpenAlex
- W2081431207
- Cited by
- 773
- References
- 8
- FWCI
- 4.16
- Type
- journal article
- Language
- en
- Open access
- closed
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- Hermans, J., Berendsen, H. J. C., Van Gunsteren, W. F., & Postma, J. P. M. (1984). A consistent empirical potential for water–protein interactions. Biopolymers. https://doi.org/10.1002/bip.360230807
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Contains information from the Semantic Scholar Academic Graph Datasets, made available under the ODC Attribution License (ODC-BY 1.0).
Semantic Scholar’s data is described in: Kinney, R., et al. (2023). The Semantic Scholar Open Data Platform. arXiv:2301.10140.