Search Result "computational calculation"
Computational Methods for Calculation of Ligand-Binding Affinity
Journal: Current Drug Targets
Volume: 9 Issue: 1 Year: 2008 Page: 1031-1039
Author(s): Walter Filgueira de Azevedo Jr., Raquel Dias
Liutex and Its Calculation and Galilean Invariance
Ebook: Current Developments in Mathematical Sciences
Volume: 2 Year: 2020
Author(s): Yiqian Wang,Yisheng Gao,Chaoqun Liu
Doi: 10.2174/9789811437601120020004
Free Energy Calculations for Cyclodextrin Inclusion Complexes
Journal: Current Organic Chemistry
Volume: 15 Issue: 6 Year: 2011 Page: 839-847
Author(s): Wen Sheng Cai, Teng Wang, Ying Zhe Liu, Peng Liu, Christophe Chipot, Xue Guang Shao
Computational Methods for Multiple Scattering at High Frequency with Applications to Periodic Structure Calculations
Ebook: Progress in Computational Physics (PiCP)
Volume: 1 Year: 2010
Author(s): X. Antoine,C. Geuzaine,K. Ramdani
Doi: 10.2174/978160805150211001010073
Accelerating Quantum Chemistry Calculations with Graphical Processing Units - Toward in High-Density (HD) Silico Drug Discovery
Journal: Current Computer-Aided Drug Design
Volume: 9 Issue: 3 Year: 2013 Page: 396-401
Author(s): Yohsuke Hagiwara,Kazuki Ohno,Masaya Orita,Ryota Koga,Toshio Endo,Yutaka Akiyama,Masakazu Sekijima
A Computational Perspective on Molecular Recognition by Galectins
Journal: Current Medicinal Chemistry
Volume: 29 Issue: 7 Year: 2022 Page: 1219-1231
Author(s): Reyes Núñez-Franco,Francesca Peccati,Gonzalo Jiménez-Osés
Free Energy Perturbation Calculations on Glucosidase-Inhibitor Complexes
Journal: Medicinal Chemistry
Volume: 1 Issue: 5 Year: 2005 Page: 455-460
Author(s): F. M. Ruiz, J. R. Grigera
Computational Aspects of Organochlorine Compounds: DFT Study and Molecular Docking Calculations
Ebook: Computational Toxicology for Drug Safety and a Sustainable Environment
Volume: 1 Year: 2023
Author(s):
Doi: 10.2174/9789815196986123010009
Computational Intelligence Methods for Docking Scores
Journal: Current Computer-Aided Drug Design
Volume: 5 Issue: 1 Year: 2009 Page: 56-68
Author(s): David Hecht, Gary B. Fogel
Computational Work with Natural Products
Ebook: Computer Based Projects for a Chemistry Curriculum
Volume: 1 Year: 2013
Author(s): Thomas J. Manning,Aurora P. Gramatges
Doi: 10.2174/9781608051939113010028