Discovery and Validation of the Binding Poses of Allosteric Fragment Hits to Protein Tyrosine Phosphatase 1b: From Molecular Dynamics Simulations to X-ray Crystallography
- DOI
- 10.1021/acs.jcim.3c00236
- Published
- 2023-04-22
- Container
- Journal of Chemical Information and Modeling
- Publisher
- American Chemical Society (ACS)
- Open access
- unknown
Credibility signals
uncertain Score 64/100 under policy 1.0.0. This is a metadata assessment, not a judgment of the paper's conclusions.
Show all credibility signals
- supportingDOI registered: A matching record was returned by Crossref.
- supportingDOI resolves: A matching record was returned by Crossref.
- not scoredDirectory of Open Access Journals: No matching DOAJ record was present in this response. No allow-list match; this is not evidence of low credibility.
- not scoredMEDLINE indexed: Not checked or no result supplied; no credibility inference made.
- not scoredOpenAlex core source: Not checked or no result supplied; no credibility inference made.
- not scoredKnown publisher allow-list: Not checked or no result supplied; no credibility inference made.
- not scoredROR affiliation: Not checked or no result supplied; no credibility inference made.
- not scoredRetraction Watch retraction: No retraction notice matched this DOI in the deployed snapshot. No matching event found; coverage may be incomplete.
- not scoredRetraction Watch expression of concern: No expression of concern notice matched this DOI in the deployed snapshot. No matching event found; coverage may be incomplete.
- not scoredRetraction Watch correction: No correction notice matched this DOI in the deployed snapshot. No matching event found; coverage may be incomplete.
- not scoredRetraction Watch reinstatement: No reinstatement notice matched this DOI in the deployed snapshot. No matching event found; coverage may be incomplete.
- not scoredOpen access status: Not checked or no result supplied; no credibility inference made.
- not scoredPublication license: Not checked or no result supplied; no credibility inference made.
- not scoredPublication version: A publication version was supplied but is not scored.
- supportingMetadata completeness: All 6 scored descriptive metadata groups are present.
Cite this work
BibTeX
@article{allodium:10.1021/acs.jcim.3c00236,
title = {Discovery and Validation of the Binding Poses of Allosteric Fragment Hits to Protein Tyrosine Phosphatase 1b: From Molecular Dynamics Simulations to X-ray Crystallography},
author = {Jack B. Greisman and Lindsay Willmore and Christine Y. Yeh and Fabrizio Giordanetto and Sahar Shahamadtar and Hunter Nisonoff and Paul Maragakis and David E. Shaw},
year = {2023},
journal = {Journal of Chemical Information and Modeling},
doi = {10.1021/acs.jcim.3c00236},
url = {https://doi.org/10.1021/acs.jcim.3c00236}
}RIS
TY - JOUR TI - Discovery and Validation of the Binding Poses of Allosteric Fragment Hits to Protein Tyrosine Phosphatase 1b: From Molecular Dynamics Simulations to X-ray Crystallography AU - Jack B. Greisman AU - Lindsay Willmore AU - Christine Y. Yeh AU - Fabrizio Giordanetto AU - Sahar Shahamadtar AU - Hunter Nisonoff AU - Paul Maragakis AU - David E. Shaw PY - 2023 JO - Journal of Chemical Information and Modeling DO - 10.1021/acs.jcim.3c00236 UR - https://doi.org/10.1021/acs.jcim.3c00236 ER -
APA
Greisman, J. B., Willmore, L., Yeh, C. Y., Giordanetto, F., Shahamadtar, S., Nisonoff, H., Maragakis, P., & Shaw, D. E. (2023). Discovery and Validation of the Binding Poses of Allosteric Fragment Hits to Protein Tyrosine Phosphatase 1b: From Molecular Dynamics Simulations to X-ray Crystallography. Journal of Chemical Information and Modeling. https://doi.org/10.1021/acs.jcim.3c00236
Source records
- crossref · retrieved 2026-09-28T16:27:19.515Z