Ibrahim Roshan Kunnakkattu, Preeti Choudhary, Lukás Pravda, Nurul Nadzirin, Oliver S. Smart, Qi Yuan, Stephen Anyango, Sreenath Nair, Mihaly Varadi, Sameer Velankar. PDBe CCDUtils: an RDKit-based toolkit for handling and analysing small molecules in the Protein Data Bank. J. Cheminformatics, 15(1):117, December 2023. [doi]
@article{KunnakkattuCPNSYANVV23,
title = {PDBe CCDUtils: an RDKit-based toolkit for handling and analysing small molecules in the Protein Data Bank},
author = {Ibrahim Roshan Kunnakkattu and Preeti Choudhary and Lukás Pravda and Nurul Nadzirin and Oliver S. Smart and Qi Yuan and Stephen Anyango and Sreenath Nair and Mihaly Varadi and Sameer Velankar},
year = {2023},
month = {December},
doi = {10.1186/s13321-023-00786-w},
url = {https://doi.org/10.1186/s13321-023-00786-w},
researchr = {https://researchr.org/publication/KunnakkattuCPNSYANVV23},
cites = {0},
citedby = {0},
journal = {J. Cheminformatics},
volume = {15},
number = {1},
pages = {117},
}