Structural and chemical basis for enhanced affinity to a series of mycobacterial thymidine monophosphate kinase inhibitors: fragment-based QSAR and QM/MM docking studies. Bueno, R. V., Toledo, N. R., Neves, B. J., Braga, R. C., & Andrade, C. H. Journal of Molecular Modeling, 19(1):179–192, Springer Science and Business Media LLC, jul, 2012.
Structural and chemical basis for enhanced affinity to a series of mycobacterial thymidine monophosphate kinase inhibitors: fragment-based QSAR and QM/MM docking studies [link]Paper  doi  bibtex   
@article{Bueno_2012,	doi = {10.1007/s00894-012-1527-8},	url = {https://doi.org/10.1007%2Fs00894-012-1527-8},	year = 2012,	month = {jul},	publisher = {Springer Science and Business Media {LLC}},	volume = {19},	number = {1},	pages = {179--192},	author = {Renata V. Bueno and Ney R. Toledo and Bruno J. Neves and Rodolpho C. Braga and Carolina H. Andrade},	title = {Structural and chemical basis for enhanced affinity to a series of mycobacterial thymidine monophosphate kinase inhibitors: fragment-based {QSAR} and {QM}/{MM} docking studies},	journal = {Journal of Molecular Modeling}}

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