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DJMol: An open-source modeling platform for computational chemistry and materials science with a Python interpreter.

Krishnamohan G. PrasannaRahul SunilKapil GuptaSeung-Cheol Lee
Published in: J. Comput. Chem. (2021)
Keyphrases
  • open source
  • materials science
  • scripting language
  • computational chemistry
  • open source software
  • source code
  • real time
  • programming language
  • scientific data
  • case study
  • expert systems