FrustratometeR: an R-package to compute local frustration in protein structures, point mutants and MD simulations.
Atilio O. RauschMaria I FreibergerCesar O. LeonettiDiego M. LunaLeandro G. RaduskyPeter G. WolynesDiego U. FerreiroR. Gonzalo ParraPublished in: Bioinform. (2021)
Keyphrases
- protein structure
- protein sequences
- molecular biology
- nuclear magnetic resonance
- secondary structure
- protein structure prediction
- amino acid sequences
- protein tertiary structure
- protein structure and function
- protein structure alignment
- physico chemical
- test cases
- amino acids
- computational approaches
- protein function
- contact map