PIKAChU: a Python-based informatics kit for analysing chemical units

Abstract As efforts to computationally describe and simulate the biochemical world become more commonplace, computer programs that are capable of in silico chemistry play an increasingly important role in biochemical research. While such programs exist, they are often dependency-heavy, difficult to...

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Bibliographic Details
Main Authors: Barbara R. Terlouw, Sophie P. J. M. Vromans, Marnix H. Medema
Format: Article
Language:English
Published: BMC 2022-06-01
Series:Journal of Cheminformatics
Subjects:
Online Access:https://doi.org/10.1186/s13321-022-00616-5