PyL3dMD: Python LAMMPS 3D molecular descriptors package.

Panwar P, Yang Q, Martini A

Open source

DOI: 10.1186/s13321-023-00737-5
Published: 2023 Jul 28
Container: Journal of cheminformatics
Publisher: Not recorded
Open access: yes

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Cite this work

BibTeX

@article{allodium:10.1186/s13321-023-00737-5,
  title = {PyL3dMD: Python LAMMPS 3D molecular descriptors package.},
  author = {Panwar P and Yang Q and Martini A},
  year = {2023},
  journal = {Journal of cheminformatics},
  doi = {10.1186/s13321-023-00737-5},
  url = {https://doi.org/10.1186/s13321-023-00737-5}
}

RIS

TY  - JOUR
TI  - PyL3dMD: Python LAMMPS 3D molecular descriptors package.
AU  - Panwar P
AU  - Yang Q
AU  - Martini A
PY  - 2023
JO  - Journal of cheminformatics
DO  - 10.1186/s13321-023-00737-5
UR  - https://doi.org/10.1186/s13321-023-00737-5
ER  -

APA

P, P., Q, Y., & A, M. (2023). PyL3dMD: Python LAMMPS 3D molecular descriptors package.. Journal of cheminformatics. https://doi.org/10.1186/s13321-023-00737-5

Source records

pubmed · retrieved 2026-11-10T19:07:54.096Z
europe-pmc · retrieved 2026-11-10T19:07:54.099Z
doaj · retrieved 2026-11-10T19:07:54.081Z