Accepted Manuscript Title: Computer-aided Drug Design and Virtual Screening of Targeted Combinatorial Libraries of Mixed-Ligand Transition Metal Complexes of 2-butanone thiosemicarbazone Authors: Tahmeena Khan, Rumana Ahmad, Iqbal Azad, Saman Raza, Seema Joshi, Abdul Rahman Khan PII: S1476-9271(17)30313-4 DOI: https://doi.org/10.1016/j.compbiolchem.2018.05.008 Reference: CBAC 6858 To appear in: Computational Biology and Chemistry Received date: 5-5-2017 Revised date: 27-4-2018 Accepted date: 7-5-2018 Please cite this article as: Khan, Tahmeena, Ahmad, Rumana, Azad, Iqbal, Raza, Saman, Joshi, Seema, Khan, Abdul Rahman, Computer-aided Drug Design and Virtual Screening of Targeted Combinatorial Libraries of Mixed-Ligand Transition Metal Complexes of 2-butanone thiosemicarbazone.Computational Biology and Chemistry https://doi.org/10.1016/j.compbiolchem.2018.05.008 This is a PDF file of an unedited manuscript that has been accepted for publication. As a service to our customers we are providing this early version of the manuscript. The manuscript will undergo copyediting, typesetting, and review of the resulting proof before it is published in its final form. Please note that during the production process errors may be discovered which could affect the content, and all legal disclaimers that apply to the journal pertain.