@ARTICLE{
author={Thomas Renjith,Mary Sheena Y,Resmi KS,Narayana Badiadka,Sarojini Baladka K,Armakovic Stevan,Armakovic Sanja J,Vijayakumar G,Van Alsenoy Christian,Mohan BJ},
year={2019},
title={Synthesis and spectroscopic study of two new pyrazole derivatives with detailed computational evaluation of their reactivity and pharmaceutical potential},
journal={JOURNAL OF MOLECULAR STRUCTURE},
volume={1181},
number={},
pages={599-612},
document_type={Article},
} 

@ARTICLE{
author={Mary Sheena Y,Miniyar Pankaj B,Mary Sheena Y,Resmi KS,Panicker C Yohannan,Armakovic Stevan,Armakovic Sanja J,Thomas Renjith,Sureshkumar Bhaskaran},
year={2018},
title={Synthesis and spectroscopic study of three new oxadiazole derivatives with detailed computational evaluation of their reactivity and pharmaceutical potential},
journal={JOURNAL OF MOLECULAR STRUCTURE},
volume={1173},
number={},
pages={469-480},
document_type={Article},
} 

@ARTICLE{
author={Smitha M,Mary Sheena Y,Hossain Mossaraf,Resmi KS,Armakovic Stevan,Armakovic Sanja J,Pavithran Rani,Nanda Ashis Kumar,Van Alsenoy Christian},
year={2018},
title={Two novel imidazole derivatives - Combined experimental and computational study},
journal={JOURNAL OF MOLECULAR STRUCTURE},
volume={1173},
number={},
pages={221-239},
document_type={Article},
} 

@ARTICLE{
author={Sureshkumar Bhaskaran,Mary Sheena Y,Resmi KS,Sumo S,Armakovic Stevan,Armakovic Sanja J,Van Alsenoy Christian,Narayana Badiadka,Sobhana D},
year={2018},
title={Spectroscopic characterization of hydroxyquinoline derivatives with bromine and iodine atoms and theoretical investigation by DFT calculations, MD simulations and molecular docking studies},
journal={JOURNAL OF MOLECULAR STRUCTURE},
volume={1167},
number={},
pages={95-106},
document_type={Article},
} 

@ARTICLE{
author={Hossain Mossaraf,Thomas Renjith,Mary Sheena Y,Resmi KS,Armakovic Stevan,Armakovic Sanja J,Nanda Ashis Kumar,Vijayakumar G,Van Alsenoy Christian},
year={2018},
title={Understanding reactivity of two newly synthetized imidazole derivatives by spectroscopic characterization and computational study},
journal={JOURNAL OF MOLECULAR STRUCTURE},
volume={1158},
number={},
pages={176-196},
document_type={Article},
} 

@ARTICLE{
author={Thomas Renjith,Hossain Mossaraf,Mary Sheena Y,Resmi KS,Armakovic Stevan,Armakovic Sanja J,Nanda Ashis Kumar,Ranjan Vivek Kumar,Vijayakumar G,Van Alsenoy Christian},
year={2018},
title={Spectroscopic analysis and molecular docking of imidazole derivatives and investigation of its reactive properties by DFT and molecular dynamics simulations},
journal={JOURNAL OF MOLECULAR STRUCTURE},
volume={1158},
number={},
pages={156-175},
document_type={Article},
} 

@ARTICLE{
author={Sureshkumar Bhaskaran,Mary Sheena Y,Resmi KS,Panicker C Yohannan,Armakovic Stevan,Armakovic Sanja J,Van Alsenoy Christian,Narayana Badiadka,Suma Somasekharan},
year={2018},
title={Spectroscopic analysis of 8-hydroxyquinoline derivatives and investigation of its reactive properties by DFT and molecular dynamics simulations},
journal={JOURNAL OF MOLECULAR STRUCTURE},
volume={1156},
number={},
pages={336-347},
document_type={Article},
} 

@ARTICLE{
author={Sureshkumar Bhaskaran,Mary Sheena Y,Panicker C Yohannan,Resmi KS,Suma Somasekharan,Armakovic Stevan,Armakovic Sanja J,Van Alsenoy Christian},
year={2017},
title={Spectroscopic analysis of 8-hydroxyquinoline-5-sulphonic acid and investigation of its reactive properties by DFT and molecular dynamics simulations},
journal={JOURNAL OF MOLECULAR STRUCTURE},
volume={1150},
number={},
pages={540-552},
document_type={Article},
}