The DOI matches its Crossref record.
Quantum Chemical Benchmark Energy and Geometry Database for Molecular Clusters and Complex Molecular Systems (www.begdb.com): A Users Manual and Examples
Open accessAbstract
Our previous benchmark CCSD(T)/ complete basis set limit calculations were collected into a database named begdb - Benchmark Energy and Geometry DataBase. Web-based interface to this database was prepared and is available at www.begdb.com. Users can browse, search and plot the data online or download structures and energy tables.
Overview
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Citations
Cited by
S66: A Well-balanced Database of Benchmark Interaction Energies Relevant to Biomolecular Structures
Řezáč, J., Riley, K. E., & Hobza, P. (2011) · Journal of Chemical Theory and Computation · doi:10.1021/ct2002946 · Cited by 1,019
Self-citationChristensen, A. S., Kubař, T., Cui, Q., & Elstner, M. (2016) · Chemical Reviews · doi:10.1021/acs.chemrev.5b00584 · Cited by 446
Brauer, B., Kesharwani, M. K., Kozuch, S., & Martin, J. M. L. (2016) · Physical Chemistry Chemical Physics · doi:10.1039/c6cp00688d · Cited by 238
Metadata
- Authors
- Řezáč, J., Jurečka, P., Riley, K. E., Černý, J., Valdes, H., Pluháčková, K., Berka, K., Řezáč, T., Pitoňák, M., Vondrášek, J., & Hobza, P.
- Venue
- Collection of Czechoslovak Chemical Communications
- Published
- 2008
- Volume
- 73
- Issue
- 10
- Pages
- 1261-1270
- ISSN
- 0010-0765 (ISSN-L)
- 1212-6950
- OpenAlex
- W1979529753
- Cited by
- 169
- References
- 0
- FWCI
- 5.61
- Type
- journal article
- Language
- en
- Open access
- bronze
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Registry, retraction, Cites and statistics results are computed, not judged, with one exception: a printed reference that no index lists is read once by a model before it counts as a citation error. Claims are extracted by a model and kept only when their quote appears verbatim in the text; each cited source is then checked, with a model’s help, for whether it says what the claim relies on. Those verdicts can be wrong — read the claim’s quote and the cited source before relying on one.
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- CoChat. (2026). Citation check: Quantum Chemical Benchmark Energy and Geometry Database for Molecular Clusters and Complex Molecular Systems (www.begdb.com): A Users Manual and Examples. https://app.cochat.ai/papers/10.1135/cccc20081261
- The paper
- Řezáč, J., Jurečka, P., Riley, K. E., Černý, J., Valdes, H., Pluháčková, K., Berka, K., Řezáč, T., Pitoňák, M., Vondrášek, J., & Hobza, P. (2008). Quantum Chemical Benchmark Energy and Geometry Database for Molecular Clusters and Complex Molecular Systems (www.begdb.com): A Users Manual and Examples. Collection of Czechoslovak Chemical Communications. https://doi.org/10.1135/cccc20081261
Data sources
Bibliographic data: Semantic Scholar, OpenAlex, Crossref.
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.
