Advancing Reproducibility and Open Data in Theoretical and Computational Chemistry.
- DOI
- 10.1021/acs.jctc.6c00733
- Published
- 2026 May 12
- Container
- Journal of chemical theory and computation
- Publisher
- Not recorded
- Open access
- unknown
Credibility signals
limited evidence Score 43/100 under policy 1.0.0. This is a metadata assessment, not a judgment of the paper's conclusions.
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- cautionMetadata completeness: 5 of 6 scored descriptive metadata groups are present; missing fields increase uncertainty.
Cite this work
BibTeX
@article{allodium:10.1021/acs.jctc.6c00733,
title = {Advancing Reproducibility and Open Data in Theoretical and Computational Chemistry.},
author = {Amaro RE and Batista V and Blumberger J and Choong YS and Corminboeuf C and Cournia Z and Cui Q and De Vivo M and Evangelista FA and Gao YQ and Ghosh D and He X and Isayev O and Khalid S and Kirchmair J and Kitchin JR and Liu H and Naidoo KJ and Nguyen D and Nunes Alves A and Palermo G and Savoie B and Soares TA and Tiwary P and Wei G and Zheng X and Zhu T and Merz KM Jr and Gagliardi L},
year = {2026},
journal = {Journal of chemical theory and computation},
doi = {10.1021/acs.jctc.6c00733},
url = {https://doi.org/10.1021/acs.jctc.6c00733}
}RIS
TY - JOUR TI - Advancing Reproducibility and Open Data in Theoretical and Computational Chemistry. AU - Amaro RE AU - Batista V AU - Blumberger J AU - Choong YS AU - Corminboeuf C AU - Cournia Z AU - Cui Q AU - De Vivo M AU - Evangelista FA AU - Gao YQ AU - Ghosh D AU - He X AU - Isayev O AU - Khalid S AU - Kirchmair J AU - Kitchin JR AU - Liu H AU - Naidoo KJ AU - Nguyen D AU - Nunes Alves A AU - Palermo G AU - Savoie B AU - Soares TA AU - Tiwary P AU - Wei G AU - Zheng X AU - Zhu T AU - Merz KM Jr AU - Gagliardi L PY - 2026 JO - Journal of chemical theory and computation DO - 10.1021/acs.jctc.6c00733 UR - https://doi.org/10.1021/acs.jctc.6c00733 ER -
APA
RE, A., V, B., J, B., YS, C., C, C., Z, C., Q, C., M, D. V., FA, E., YQ, G., D, G., X, H., O, I., S, K., J, K., JR, K., H, L., KJ, N., D, N., A, N. A., G, P., B, S., TA, S., P, T., G, W., X, Z., T, Z., Jr, M. K., & L, G. (2026). Advancing Reproducibility and Open Data in Theoretical and Computational Chemistry.. Journal of chemical theory and computation. https://doi.org/10.1021/acs.jctc.6c00733
Source records
- pubmed · retrieved 2026-09-26T07:52:23.229Z