Search Result "fragment descriptors"
Building a Chemical Space Based on Fragment Descriptors
Ebook: Advances in Combinatorial Chemistry & High Throughput Screening
Volume: 1 Year: 2013
Author(s): Igor I. Baskin,Alexandre Varnek
Doi: 10.2174/9781608057450113010005
Building a Chemical Space Based on Fragment Descriptors
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 11 Issue: 8 Year: 2008 Page: 661-668
Author(s): Igor Baskin, Alexandre Varnek
Random Molecular Fragment Methods in Computational Medicinal Chemistry
Journal: Current Medicinal Chemistry
Volume: 15 Issue: 2 Year: 2008 Page: 2108-2121
Author(s): Eugen Lounkine, Jose Batista, Jurgen Bajorath
ISIDA - Platform for Virtual Screening Based on Fragment and Pharmacophoric Descriptors
Journal: Current Computer-Aided Drug Design
Volume: 4 Issue: 3 Year: 2008 Page: 191-198
Author(s): Alexandre Varnek, Denis Fourches, Dragos Horvath, Olga Klimchuk, Cedric Gaudin, Philippe Vayer, Vitaly Solovev, Frank Hoonakker, Igor V. Tetko, Gilles Marcou
Structural Similarity and Descriptor Spaces for Clustering and Development of QSAR Models§
Journal: Current Computer-Aided Drug Design
Volume: 9 Issue: 2 Year: 2013 Page: 254-271
Author(s): Irene Luque Ruiz,Gonzalo Cerruela Garcia,Miguel Angel Gomez-Nieto
“In Silico” Design of Potential Anti-HIV Actives Using Fragment Descriptors
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 8 Issue: 5 Year: 2005 Page: 403-416
Author(s): A. Varnek, V. P. Solovev
Multi-Target Inhibitors for Proteins Associated with Alzheimer: In Silico Discovery using Fragment-Based Descriptors
Journal: Current Alzheimer Research
Volume: 10 Issue: 2 Year: 2013 Page: 117-124
Author(s): Alejandro Speck-Planche,Valeria V. Kleandrova,Feng Luan,M. Natalia D. S. Cordeiro
Probing a Chemical Space for Fragmental Topology-Activity Landscapes (FRAGTAL): Application for Diketo Acid and Catechol HIV Integrase Inhibitor Offspring Fragments
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 16 Issue: 4 Year: 2013 Page: 274-287
Author(s): Andrzej Bak,Tomasz Magdziarz,Agata Kurczyk,Katarzyna Serafin,Jaroslaw Polanski
Application of SMILES Notation Based Optimal Descriptors in Drug Discovery and Design
Journal: Current Topics in Medicinal Chemistry
Volume: 15 Issue: 18 Year: 2015 Page: 1768-1779
Author(s): Aleksandar M. Veselinovic,Jovana B. Veselinovic,Jelena V. Zivkovic,Goran M. Nikolic
Theoretical Modeling of HPV: QSAR and Novodesign with Fragment Approach
Journal: Current Computer-Aided Drug Design
Volume: 10 Issue: 4 Year: 2014 Page: 303-314
Author(s): Girinath G. Pillai,Lauri Sikk,Tarmo Tamm,Mati Karelson,Peeter Burk,Kaido Tamm