Machine learning approaches for customized docking scores: Modeling of inhibition of Mycobacterium tuberculosis enoyl acyl carrier protein reductase

2010 ◽  
Author(s):  
Gary B. Fogel ◽  
Jonathan Tran ◽  
Stephen Johnson ◽  
David Hecht
Keyword(s):  
Machine Learning ◽  
Mycobacterium Tuberculosis ◽  
Acyl Carrier Protein ◽  
Carrier Protein ◽  
Learning Approaches

Piperazine derivatives: Synthesis, inhibition of the Mycobacterium tuberculosis enoyl-acyl carrier protein reductase and SAR studies

2015 ◽  
Vol 90 ◽  
pp. 436-447 ◽  
Author(s):  
Mariane Rotta ◽  
Kenia Pissinate ◽  
Anne Drumond Villela ◽  
Davi Fernando Back ◽  
Luis Fernando Saraiva Macedo Timmers ◽  
...  
Keyword(s):  
Mycobacterium Tuberculosis ◽  
Acyl Carrier Protein ◽  
Carrier Protein ◽  
Synthesis Inhibition ◽  
Piperazine Derivatives ◽  
Sar Studies

Structure–Function Analysis of the Acyl Carrier Protein Synthase (AcpS) from Mycobacterium tuberculosis

2009 ◽  
Vol 393 (4) ◽  
pp. 937-950 ◽  
Author(s):  
Orly Dym ◽  
Shira Albeck ◽  
Yoav Peleg ◽  
Alon Schwarz ◽  
Zippora Shakked ◽  
...  
Keyword(s):  
Mycobacterium Tuberculosis ◽  
Structure Function ◽  
Acyl Carrier Protein ◽  
Function Analysis ◽  
Carrier Protein

Design, synthesis and evaluation of diphenyl ether analogues as antitubercular agents

RSC Advances ◽  
2016 ◽  
Vol 6 (112) ◽  
pp. 110571-110582 ◽  
Author(s):  
Bharathkumar Inturi ◽  
Gurubasavaraj V. Pujar ◽  
Madhusudhan N. Purohit ◽  
Viswanathan B. Iyer ◽  
Sowmya G. S. ◽  
...  
Keyword(s):  
Mycobacterium Tuberculosis ◽  
Drug Design ◽  
Acyl Carrier Protein ◽  
Diphenyl Ether ◽  
Design Approach ◽  
Carrier Protein ◽  
Antitubercular Agents ◽  
Structure Based Drug Design ◽  
Design Synthesis ◽  
Diphenyl Ethers

We herein report the investigation of new diphenyl ethers asMycobacterium tuberculosisenoyl-acyl carrier protein reductase (InhA) inhibitors by structure-based drug design approach.

scholarly journals X-Ray Crystal Structure of Mycobacterium tuberculosis β-Ketoacyl Acyl Carrier Protein Synthase II (mtKasB)

2007 ◽  
Vol 366 (2) ◽  
pp. 469-480 ◽  
Author(s):  
Sudharsan Sridharan ◽  
Lei Wang ◽  
Alistair K. Brown ◽  
Lynn G. Dover ◽  
Laurent Kremer ◽  
...  
Keyword(s):  
Crystal Structure ◽  
Mycobacterium Tuberculosis ◽  
Acyl Carrier Protein ◽  
Carrier Protein ◽  
X Ray
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