In silico based virtual screening and mixed mode QM/MM calculation identifies caffeine scaffold for designing potential inhibitors for tyrosyl tRNA synthetase of M ycobacterium tuberculosis.
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| Title: | In silico based virtual screening and mixed mode QM/MM calculation identifies caffeine scaffold for designing potential inhibitors for tyrosyl tRNA synthetase of M ycobacterium tuberculosis. |
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| Authors: | Sathya, Rajendran1, Thamotharan, Subbiah1 |
| Source: | International Journal of Quantum Chemistry. Feb2015, Vol. 115 Issue 3, p187-195. 10p. |
| Database: | Academic Search Ultimate |
| ISSN: | 00207608 |
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| DOI: | 10.1002/qua.24814 |