Связанные научные тематики:
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 Найдено научных статей и публикаций: 4, для научной тематики: Virtual screening


1.

Synthesis of New Congeners of 1-methyl-3-aminoisoquinolines, Evaluation of Their Cytotoxic Activity, In Silico and In Vitro Study of Their Molecular Targets as PDE4B. (публикация автора на scipeople)     

Lapa GB, Tsunoda T, Shirasawa S, et al - Chem Biol Drug Des. , 2016
Chem Biol Drug Des. 2016 Apr;87(4):575-82. doi: 10.1111/cbdd.12691. Epub 2015 Dec 29.
2.

Virtual screening for potential substances for the prophylaxis of HIV infection in libraries of commercially available organic compounds (публикация автора на scipeople)   

Lagunin A.A., Filimonov D.A., Gloriozova T.A., Tarasova O.A., Zakharov A.V., Guasch L., Nicklaus M.C., Poroikov V.V. - Pharmaceutical Chemistry Journal , 2013
Pharmaceutical Chemistry Journal, 2013, 47 (7), 343-360.
3.

Building a chemical space based on fragment descriptors (публикация автора на scipeople)   

I. Baskin, A. Varnek - Combinatorial Chemistry and High Throughput Screening , 2008
Combinatorial Chemistry and High Throughput Screening, Volume 11, Issue 8, September 2008, Pages 661-668. DOI: 10.2174/138620708785739907
4.

Rational design of macrolides by virtual screening of combinatorial libraries generated through in silico manipulation of polyketide synthases (публикация автора на scipeople)   

Zotchev S.B., Stepanchikova A.V., Sergeyko A.P., Sobolev B.N., Filimonov D.A., Poroikov V.V. - Journal of Medicinal Chemistry , 2006
Journal of Medicinal Chemistry, 2006, 49 (6), 2077-2087.