Direct calculation of the binding free energies of FKBP ligands
Journal Article
Overview
publication date
- August 22, 2005
has subject area
- Biochemical Phenomena - Protein Binding
- Biological Science Disciplines - Biophysics
- Biological Science Disciplines - Drug Design
- Chemistry - Drug Design
- Chemistry, Physical
- Entropy
- Humans
- Investigative Techniques - Drug Design
- Ligands
- Metabolism - Protein Binding
- Models, Chemical
- Models, Theoretical
- Molecular Conformation
- Peptidylprolyl Isomerase - Tacrolimus Binding Proteins
- Pharmacological Phenomena - Dose-Response Relationship, Drug
- Physics - Biophysics
- Protein Conformation
- Receptors, Drug - Tacrolimus Binding Proteins
- Receptors, Immunologic - Tacrolimus Binding Proteins
- Thermodynamics
- Time Factors
- Toxicological Phenomena - Dose-Response Relationship, Drug
has restriction
- closed
Date in CU Experts
- September 4, 2015 2:15 AM
Full Author List
- Fujitani H; Tanida Y; Ito M; Jayachandran G; Snow CD; Shirts MR; Sorin EJ; Pande VS
author count
- 8
citation count
- 167
published in
- Journal of Chemical Physics Journal
Other Profiles
International Standard Serial Number (ISSN)
- 0021-9606
Electronic International Standard Serial Number (EISSN)
- 1089-7690
Digital Object Identifier (DOI)
Additional Document Info
volume
- 123
issue
- 8
number
- ARTN 084108