Expand description
§Glue together overlapping intervals of either entropic sampling or wang landau
Use this, if it makes sense to split the range, you are interested in, into multiple intervals
Modules§
- derivative
- Module for numeric derivatives
Structs§
- Glue
Entry - Struct that is used to create a glue job
- GlueJob
- Used to merge probability densities from WL, REWL, Entropic or REES simulations
- Glue
Stats - Includes statistics about the intervals from which the gluing result stems from
- Glued
- Result of the gluing
- Interval
SimStats - Statistics of one interval, used to gauge how well the simulation works etc.
Enums§
- Glue
Errors - Possible errors that can occur during gluing together WangLandau intervals or Entropic Sampling intervals
- Glue
Write Verbosity - Which level of verbosity do you want?
- LogBase
- Which LogBase is being used/should be used?
- SimProgress
- Enum which contains information about the current progress of the simulation
- Simulation
Type - Enum to track simulation type
Traits§
Functions§
- average_
merged_ and_ aligned - Calculate the probability density function from overlapping intervals
- derivative_
merged_ and_ aligned - Calculate the probability density function from overlapping intervals
- norm_
log10_ sum_ to_ 1 - Normalize log10 probability density