Towards Computational Prediction of Anti-Cancer Activity: Making Connection between IC50 Values and Metal−Ligand Interaction Energies in some NHC Complexes of Groups 10 and 11
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DOI: 10.1016/j.molliq.2021.117310
Abstract: Abstract Finding a logical relation between the IC50 values of anticancer drugs and a computationally calculated physical quantity of them can be very useful in predicting and designing new drugs, reduces the time and cost… read more here.
Keywords: interaction energies; ic50; nhc nhc; ic50 values ... See more keywords