All Stories

  1. Effect of Solvent on Antioxidant Activity of Zanthoxylum oxyphyllum Edgew and its DFT Study
  2. N-heterocyclic carbone: computational prediction of a divalent carbon (0) compound
  3. Switching of carbene spin states: effect of hydrogen bond donors
  4. Effect of substituent and solvent on cation–π interactions in benzene and borazine: a computational study