Workflow-dependent conformational landscape fragmentation and quantitative failure modes in 3D molecular embedding of 33,715 bioactive compounds

Alexandra Farcaş, Lorentz Jäntschi

Open source

DOI
10.1016/j.jmgm.2026.109611
Published
2027-01
Container
Journal of Molecular Graphics and Modelling
Publisher
Elsevier BV
Open access
unknown

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BibTeX

@article{allodium:10.1016/j.jmgm.2026.109611,
  title = {Workflow-dependent conformational landscape fragmentation and quantitative failure modes in 3D molecular embedding of 33,715 bioactive compounds},
  author = {Alexandra Farcaş and Lorentz Jäntschi},
  year = {2027},
  journal = {Journal of Molecular Graphics and Modelling},
  doi = {10.1016/j.jmgm.2026.109611},
  url = {https://doi.org/10.1016/j.jmgm.2026.109611}
}

RIS

TY  - JOUR
TI  - Workflow-dependent conformational landscape fragmentation and quantitative failure modes in 3D molecular embedding of 33,715 bioactive compounds
AU  - Alexandra Farcaş
AU  - Lorentz Jäntschi
PY  - 2027
JO  - Journal of Molecular Graphics and Modelling
DO  - 10.1016/j.jmgm.2026.109611
UR  - https://doi.org/10.1016/j.jmgm.2026.109611
ER  - 

APA

Farcaş, A., & Jäntschi, L. (2027). Workflow-dependent conformational landscape fragmentation and quantitative failure modes in 3D molecular embedding of 33,715 bioactive compounds. Journal of Molecular Graphics and Modelling. https://doi.org/10.1016/j.jmgm.2026.109611

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