List of all items
Structs
- BigSmiles
- builder::branched::BranchedBuilder
- builder::ensemble::EnsembleBuilder
- builder::linear::LinearBuilder
- distribution::flory::Flory
- distribution::log_normal::LogNormal
- distribution::schulz_zimm::SchulzZimm
- polymer::chain::MonomerUnit
- polymer::chain::PolymerChain
- polymer::ensemble::PolymerEnsemble
- properties::ensemble::EnsembleStats
Enums
- builder::linear::GradientProfile
- builder::strategy::BuildStrategy
- error::PolySimError
- polymer::chain::Architecture
- properties::thermal::CrystallizationTendency
Traits
Functions
- parse
- properties::formula::molecular_formula
- properties::formula::total_atom_count
- properties::molecular_weight::average_mass
- properties::molecular_weight::monoisotopic_mass
- properties::thermal::crystallization_tendency
- properties::thermal::tg_fox
- properties::thermal::tg_van_krevelen