gt4sd.algorithms.conditional_generation.guacamol.implementation.moses_organ module¶
Moses Organ implementation.
Summary¶
Classes:
Reference¶
- class Organ(model_path, model_config_path, vocab_path, n_samples, n_batch, max_len, device='cpu')[source]¶
Bases:
object- __init__(model_path, model_config_path, vocab_path, n_samples, n_batch, max_len, device='cpu')[source]¶
Initialize Organ.
- Parameters
model_path (
str) – path from where to load the model.model_config_path (
str) – path from where to load the model config.vocab_path (
str) – path from where to load the vocab.n_samples (
int) – number of samples to sample.n_batch (
int) – size of the batch.max_len (
int) – max length of SMILES.device (
str) – device used for computation. Defaults to cpu.
- get_generator()[source]¶
Create an instance of the OrganGenerator.
- Return type
OrganGenerator- Returns
an instance of OrganGenerator.
- __dict__ = mappingproxy({'__module__': 'gt4sd.algorithms.conditional_generation.guacamol.implementation.moses_organ', '__init__': <function Organ.__init__>, 'get_generator': <function Organ.get_generator>, '__dict__': <attribute '__dict__' of 'Organ' objects>, '__weakref__': <attribute '__weakref__' of 'Organ' objects>, '__doc__': None, '__annotations__': {}})¶
- __doc__ = None¶
- __module__ = 'gt4sd.algorithms.conditional_generation.guacamol.implementation.moses_organ'¶
- __weakref__¶
list of weak references to the object (if defined)