scholarly article | Q13442814 |
P356 | DOI | 10.1016/J.JMGM.2020.107770 |
P698 | PubMed publication ID | 33065513 |
P2093 | author name string | Rakesh Srivastava | |
Andrew M Lynn | |||
Niranjan Kumar | |||
Amresh Prakash | |||
P2860 | cites work | SMILES, a chemical language and information system. 1. Introduction to methodology and encoding rules | Q28090714 |
PTRAJ and CPPTRAJ: Software for Processing and Analysis of Molecular Dynamics Trajectory Data | Q31026348 | ||
Epik: a software program for pK( a ) prediction and protonation state generation for drug-like molecules | Q81360455 | ||
P921 | main subject | Mycobacterium tuberculosis | Q130971 |
virtual screening | Q4112105 | ||
P304 | page(s) | 107770 | |
P577 | publication date | 2020-10-07 | |
P1433 | published in | Journal of Molecular Graphics & Modelling | Q3186928 |
P1476 | title | Virtual screening and free energy estimation for identifying Mycobacterium tuberculosis flavoenzyme DprE1 inhibitors | |
P478 | volume | 102 |
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