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Please use this identifier to cite or link to this collection: DOI: 10.19061/iochem-bd-6-643

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View as: Tree List

ROOT
- Au-1
- Au-1_and_Au-4_RXN_pathways
  - I1
    - Au-1
      - TS
      - displacement_back
      - displacement_foward
    - Au-4
      - TS
      - displacement_back
      - displacement_foward
  - I2
    - Au-1
    - Au-4
  - I2_CScoupled_product
    - Au-1
      - TS
      - displacement_backward
      - displacement_foward
    - Au-4
      - TS
      - displacement_backward
      - displacement_foward
  - I3
    - Au-1
      - TS
      - displacement_backward
      - displacement_foward
      - product
    - Au-4
      - TS
      - displacement_backwards
      - displacement_fowards
      - lowest_energy_product
  - I3_I4_CHprotonation
    - Au-1
    - Au-4
      - TS
      - displacement_backward
      - displacement_foward
      - product
  - I5
    - Au-4
      - TS
      - displacement_backward
      - displacement_foward
  - I6
  - I7
  - MISC
    - CN_ligands
      - Au-1
        
        protonated
      - Au-4
        
        protonated
    - Cl
    - DMSO
      - protonated
      - standard
    - NAC_disulfide
    - NAC_ligand
      - S-_COOH
      - SH_COO-
      - SH_COOH
  - R
    - Au-1
    - Au-4
- Au-2
- Au-3
- Au-6
- Au-7
- HTS

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