Search Result "langevin dynamics simulation"
A Monte Carlo Assisted Simulation of Stochastic Molecular Dynamics for Folding of the Protein Crambin in a Viscous Environment
Ebook: Applied Biomathematics for Nucleic Acid Chemistry and Protein Folding: Quantitative Simulations
Volume: 1 Year: 2023
Author(s):
Doi: 10.2174/9789815179965123010006
Ld/Mm+ Simulation of Some Aristolochic and Humic Acids Species Coupledin Periodic Box with Water
Journal: Current Computer-Aided Drug Design
Volume: 17 Issue: 6 Year: 2021 Page: 708-724
Author(s): Mihai Viorel Putz,Feng Chen Ifrim
Functional Dynamics of Proteins Elucidated by Statistical Analysis of Simulation Data
Journal: Current Physical Chemistry
Volume: 2 Issue: 4 Year: 2012 Page: 443-451
Author(s): Burak Alakent,Zeynep Kurkcuoglu,Pemra Doruker
Deciphering the Flexibility and Dynamics of Geobacillus zalihae Strain T1 Lipase at High Temperatures by Molecular Dynamics Simulation (Supplementary Material)
Journal: Protein & Peptide Letters
Volume: 16 Issue: 1 Year: 2009 Page: 1360-1370
Author(s): Mohd Basyaruddin Abdul Rahman, Roghayeh Abedi Karjiban, Abu Bakar Salleh, Donald Jacobs, Mahiran Basri, Adam Leow Thean Chor, Habibah Abdul Wahab, Raja Noor Zaliha Raja Abd Rahman
Molecular Simulation in Drug Design: An Overview of Molecular Dynamics Methods
Ebook: Applied Computer-Aided Drug Design: Models and Methods
Volume: 1 Year: 2023
Author(s):
Doi: 10.2174/9789815179934123010009
Protonation States in Molecular Dynamics Simulations of Peptide Folding and Binding
Journal: Current Pharmaceutical Design
Volume: 19 Issue: 2 Year: 2013 Page: 4173-4181
Author(s): Avraham Ben- Shimon, Deborah E. Shalev, Masha Y. Niv
Deliberations and Considerations of Mesodyn Simulations in Pharmaceuticals
Ebook: Software and Programming Tools in Pharmaceutical Research
Volume: 1 Year: 2024
Author(s):
Doi: 10.2174/9789815223019124010012
Ecology of Protein Dynamics
Journal: Current Physical Chemistry
Volume: 3 Issue: 1 Year: 2013 Page: 9-16
Author(s): Giuseppe Zaccai
Molecular Dynamics Simulations of Metalloproteinases Types 2 and 3 Reveal Differences in the Dynamic Behavior of the S1 Binding Pocket
Journal: Current Pharmaceutical Design
Volume: 13 Issue: 3 Year: 2007 Page: 3471-3475
Author(s): Cesar Augusto F. de Oliveira, Maurice Zissen, John Mongon, J. Andrew Mccammon
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