A quasi-SMILES based QSPR Approach towards the prediction of adsorption energy of Ziegler − Natta catalysts for propylene polymerization

Materials Discovery

Volumn 5, Issue , 2016, Pages 22-28

  Achary, P Ganga Raju ^a   Begum, Sanija ^a   Toropova, Alla P ^b   Toropov, Andrey A ^b  

^a SIKSHA O ANUSANDHAN DEEMED TO BE UNIVERSITY   (India)

^b MARIO NEGRI INSTITUTE FOR PHARMACOLOGICAL RESEARCH   (Italy)

Author keywords

adsorption energies; Modeling and simulation; Propylene polymerization; Quantitative structure property relationships; Quasi SMILES

Indexed keywords

EID: 85008428213     PISSN: None     EISSN: 23529245     Source Type: Journal    
DOI: 10.1016/j.md.2016.12.003     Document Type: Article

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