Search Result "Implicit solvent/membrane model"
Recent Applications of Replica-Exchange Molecular Dynamics Simulations of Biomolecules
Journal: Current Physical Chemistry
Volume: 2 Issue: 4 Year: 2012 Page: 401-412
Author(s): Yuji Sugita,Naoyuki Miyashita,Pai-Chi Li,Takao Yoda,Yuko Okamoto
Molecular Modelling Approaches to Antibacterial Drug Design and Discovery
Ebook: Frontiers in Anti-Infective Drug Discovery
Volume: 7 Year: 2018
Author(s): Agnieszka A. Kaczor,Prasanthi Medarametla,Damian Bartuzi,Magdalena Kondej,Dariusz Matosiuk,Antti Poso
Doi: 10.2174/9781681085623118070006
Antimicrobial and Cell-Penetrating Peptides: Structure, Assembly and Mechanisms of Membrane Lysis via Atomistic and Coarse-Grained Molecular Dynamic Simulations
Journal: Protein & Peptide Letters
Volume: 17 Issue: 1 Year: 2010 Page: 1313-1327
Author(s): Peter J. Bond, Syma Khalid
A Practical Guide to Molecular Docking and Homology Modelling for Medicinal Chemists
Journal: Current Topics in Medicinal Chemistry
Volume: 17 Issue: 18 Year: 2017 Page: 2023-2040
Author(s): Anna E. Lohning,Stephan M. Levonis,Billy Williams-Noonan,Stephanie S. Schweiker
Customizing G Protein-Coupled Receptor Models for Structure-Based Virtual Screening
Journal: Current Pharmaceutical Design
Volume: 15 Issue: 3 Year: 2009 Page: 4026-4048
Author(s): Chris de Graaf, Didier Rognan
The In Silico Insights of α-Adrenergic Receptors Over the Last Decade: Methodological Approaches and Structural Features of the 3D Models
Journal: Current Topics in Medicinal Chemistry
Volume: 7 Issue: 2 Year: 2007 Page: 195-205
Author(s): Antonio Carrieri, Alessandra Fano
Comparative Modeling: The State of the Art and Protein Drug Target Structure Prediction
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 14 Issue: 6 Year: 2011 Page: 532-547
Author(s): Tianyun Liu, Grace W. Tang, Emidio Capriotti
Implications of the Dominant Role of Transporters in Drug Uptake by Cells (Supplementary Material)
Journal: Current Topics in Medicinal Chemistry
Volume: 9 Issue: 2 Year: 2009 Page: 163-181
Author(s): Paul D. Dobson, Karin Lanthaler, Stephen G. Oliver, Douglas B. Kell
Recent Advances in Computational Modeling of α
Journal: Current Protein & Peptide Science
Volume: 13 Issue: 7 Year: 2012 Page: 644-657
Author(s): Anton A. Polyansky,Anton O. Chugunov,Alexander A. Vassilevski,Eugene V. Grishin,Roman G. Efremov
Protein Flexibility and Ligand Recognition: Challenges for Molecular Modeling
Journal: Current Topics in Medicinal Chemistry
Volume: 11 Issue: 2 Year: 2011 Page: 192-210
Author(s): Francesca Spyrakis, Axel BidonChanal, Xavier Barril, F. Javier Luque