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Molecular Dynamics Simulation of Cytochrome c3: Studying the Reduction Processes Using Free Energy Calculations

โœ Scribed by Soares, C.M.; Martel, P.J.; Mendes, J.; Carrondo, M.A.


Book ID
119411724
Publisher
Biophysical Society
Year
1998
Tongue
English
Weight
423 KB
Volume
74
Category
Article
ISSN
0006-3495

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## Abstract The standard (absolute) binding free energy of the antibiotic sparsomycin with the 50S bacteria ribosomal subunit is calculated using molecular dynamics (MD) free energy perturbation (FEP) simulations with restraining potentials developed by Wang __et al.__ [Biophys. J. 91:2798โ€“2814 (20