A clustering-based biased Monte Carlo approach to protein titration curve prediction.
Arun V. SathanurNathan A. BakerPublished in: ICMLA (2020)
Keyphrases
- monte carlo
- subcellular localization
- protein secondary structure
- contact map
- protein structure prediction
- monte carlo simulation
- importance sampling
- markov chain
- drug design
- protein secondary structure prediction
- monte carlo methods
- particle filter
- adaptive sampling
- stochastic approximation
- protein sequences
- simulation study
- point processes
- protein interaction
- protein structure
- monte carlo tree search
- protein protein interactions
- matrix inversion
- contact maps
- physicochemical properties
- genetic algorithm
- game tree search
- variance reduction
- state space
- global illumination
- markov chain monte carlo
- computational cost
- machine learning
- experimentally determined
- remote homology detection