Browsing Kimya ve Kimyasal İşleme Teknolojileri-Makale Koleksiyonu by Subject "Genetic Algorithm"

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4D-QSAR analysis and pharmacophore modeling: Electron conformational-genetic algorithm approach for penicillins

Yanmaz, Ersin; Sarıpınar, Emin; Şahin, Kader; Geçen, Nazmiye; Çopur, Fatih (Pergamon-Elsevier Science Ltd, 2011)

4D-QSAR studies were performed on a series of 87 penicillin analogues using the electron conformational-genetic algorithm (EC-GA) method. In this EC-based method, each conformation of the molecular system is described by ...
4d-qsar study of hept derivatives by electron conformational-genetic algorithm method

Akyüz, Lalehan; Sarpınar, Emin; Kaya, Ebru; Yanmaz, Ersin (Taylor & Francis Ltd, 2012)

In this work, the EC-GA method, a hybrid 4D-QSAR approach that combines the electron conformational (EC) and genetic algorithm optimization (GA) methods, was applied in order to explain pharmacophore (Pha) and predict ...