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PSW-Designer: An Open-Source Computational Platform for the Design and Virtual Screening of Photopharmacological Ligands.

Icaro A. SimonEvert J. HomanMaikel WijtmansMichael SundströmRob LeursIwan J. P. de EschBarbara Zarzycka
Published in: J. Chem. Inf. Model. (2023)
Keyphrases
  • open source
  • virtual screening
  • design process
  • case study
  • user interface
  • drug discovery
  • databases
  • high dimensional data
  • computational model