scholarly journals Computational design of new molecular scaffolds for medicinal chemistry, part II: generalization of analog series-based scaffolds

2018 ◽  
Vol 4 (2) ◽  
pp. FSO267 ◽  
Author(s):  
Dilyana Dimova ◽  
Dagmar Stumpfe ◽  
Jürgen Bajorath
Keyword(s):  
Medicinal Chemistry ◽  
Computational Design ◽  
Molecular Scaffolds ◽  
Analog Series

Advances in the development of pyridinone derivatives as non-nucleoside reverse transcriptase inhibitors

RSC Advances ◽  
2016 ◽  
Vol 6 (3) ◽  
pp. 2119-2130 ◽  
Author(s):  
Hugo Vite-Caritino ◽  
Oscar Méndez-Lucio ◽  
Héctor Reyes ◽  
Alberto Cabrera ◽  
Daniel Chávez ◽  
...  
Keyword(s):  
Reverse Transcriptase ◽  
Medicinal Chemistry ◽  
Computational Design ◽  
Reverse Transcriptase Inhibitors ◽  
Nucleoside Reverse Transcriptase Inhibitors ◽  
Biological Screening ◽  
Hiv Aids

Medicinal chemistry, computational design and biological screening have advanced pyridin-2(1H)-one derivatives as a promising class of non-nucleoside reverse transcriptase inhibitors for the treatment of HIV/AIDS.

Computational Exploration of Molecular Scaffolds in Medicinal Chemistry

2016 ◽  
Vol 59 (9) ◽  
pp. 4062-4076 ◽  
Author(s):  
Ye Hu ◽  
Dagmar Stumpfe ◽  
Jürgen Bajorath
Keyword(s):  
Medicinal Chemistry ◽  
Molecular Scaffolds ◽  
Computational Exploration
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