TY  - GEN
AU  - Jayachandran,Guha
AU  - Shirts,Michael R
AU  - Park,Sanghyun
AU  - Pande,Vijay S
TI  - Parallelized-over-parts computation of absolute binding free energy with docking and molecular dynamics
SN  - 0021-9606
PY  - 2007///0727
KW  - Biophysics
KW  - methods
KW  - Chemistry, Physical
KW  - Cluster Analysis
KW  - Computer Simulation
KW  - Humans
KW  - Ligands
KW  - Models, Chemical
KW  - Models, Statistical
KW  - Molecular Conformation
KW  - Probability
KW  - Protein Binding
KW  - Proteins
KW  - chemistry
KW  - Tacrolimus Binding Protein 1A
KW  - Thermodynamics
N1  - Publication Type: Journal Article; Research Support, N.I.H., Extramural; Research Support, U.S. Gov't, Non-P.H.S
UR  - https://doi.org/10.1063/1.2221680
ER  -