files
Full documentation pages are generated for docstring reference only and may contain symbols imported from other modules. Imported symbols are not distinguished from locally defined symbols and will appear in any module that they are imported into. For better information on where symbols should be imported from, review the sourcecode on the github.
FoSpy.blocks.files
FileBlock
Bases: SingleBlock
Represents a set of blocks loaded from a file.
All public attributes of FileBlock objects are either SingleBlock or
ListBlock objects. Attributes without a header at the start of the file
are parsed into {"metadata": blockDict} before passing to FileBlock.
Noteable Subclasses:
Source code in FoSpy/blocks/files.py
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__init__
Optionally specify _sourceFile before constructing from blockDict using parent SingleBlock constructor.
Source code in FoSpy/blocks/files.py
check_attachments
cleanup
fromFile
classmethod
Source code in FoSpy/blocks/files.py
matches_file
save
Sends a serialized dict to be written to file.
Parameters:
| Name | Type | Description | Default |
|---|---|---|---|
filepath
|
str
|
If specified, writes serialized dict to filepath. ks to |
None
|
json_indent
|
Indent to use for json.dump when saving as json |
4
|
|
**kwargs
|
Optional kwargs to pass to saving routine (unique to each file extension) |
{}
|
Raises:
| Type | Description |
|---|---|
ValueError
|
If _sourceFile is not specified (if |
Source code in FoSpy/blocks/files.py
SingleBlock
Bases: Block
Represents a single block of key:value pairs parsed from a FOS file.
Subclasses are mapped to expected keys and validation routines in
..parsing.validation. Expected values are validated and assigned to
public attributes. Unexpected values are assigned to attributes of
self.ext for safety, but can still be accessed as an attribute of the
SingleBlock object if not overwritten
Notable Subclasses:
FileBlock(SingleBlock)
Synthesis(FileBlock)
Reaction(SingleBlock)
Material(SingleBlock)
TemplateBlock(SingleBlock)
Source code in FoSpy/blocks/blocks.py
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TemplateClass
classmethod
Create a template for a subclass of SingleBlock.
Generates a hybridized subclass of the current block class and
TemplateBlock. Template
subclasses override original expected validators with either a
TemplateField,
TemplateBlock, or
TemplateList depending on the
type of the original validator.
Parameters:
| Name | Type | Description | Default |
|---|---|---|---|
*args
|
str
|
A list of properties to override as template types. |
()
|
Source code in FoSpy/blocks/blocks.py
__delattr__
__eq__
Check equality of two SingleBlock objects.
Equality is checked by a deep difference of their serialized dictionaries.
Parameters:
| Name | Type | Description | Default |
|---|---|---|---|
suppress_routine_paths
|
bool
|
Optional flag to still return true if the only differences found are in calculation routine metadata. Calculation routines are for user information only and may not be relevant for equality. |
False
|
Source code in FoSpy/blocks/blocks.py
__getattr__
Check both self and self.ext for attribute before returning.
A matching attribute of self will be returned first, but if self has
no matching attribute, a matching attribute of self.ext can be
returned instead.
Source code in FoSpy/blocks/blocks.py
__hash__
__init__
Constructs a SingleBlock object from a dictionary.
Avoid using this constructor for unfamiliar block classes, it may bypass
subclass delegation. Use
dispatch_subclass
instead.
SingleBlocks are constructed recursively from an arbitrarily nested
dictionary. All keys identified by SingleBlock.build_req_validators()
must be present at the top level. Required keys at nested levels are
handled by the recursed constructor.
Parameters:
| Name | Type | Description | Default |
|---|---|---|---|
blockDict
|
dict
|
An arbitrarily nested dictionary mapping attribute names to values. Unexpected attributes will be assigned under It is possible to pass a blockDict already containing objects, but validation routines will fail if objects are not the correct type. Best practice is to serialize all nested objects into lists, dicts, and strings to allow full type coersion. |
required |
_dispatched
|
Flag passed by
|
False
|
Raises:
| Type | Description |
|---|---|
ValueError
|
A key required by |
TypeError
|
The value passed as |
Source code in FoSpy/blocks/blocks.py
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__setattr__
Assign an attribute with validation and controlled namespace behavior.
Contract
SingleBlock enforces type correctness and validator execution for
all public attributes defined for its subclass.
Required types and validators are mapped by subclass in
parsing.validation
Comment-mutating methods are attached to every object assigned to an
attribute. (See
add_comments)
Rules
- Private attributes (
_-prefixed) bypass validation. - Attributes with registered validators are processed through the validator before assignment.
- Attributes with required types are coerced by calling the type constructor when necessary.
- Unrecognized attributes can be assigned to a validator mapped to
an alias in
parsing.validation, using the syntaxname="name$alias". - Unrecognized attribute names are redirected as attributes of
self.ext.
Raises:
| Type | Description |
|---|---|
ValueError
|
|
Source code in FoSpy/blocks/blocks.py
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_assign_and_inject
Attaches attributes and methods to any value before assigning it as an
attribute of self or self.ext.
Attributes Attached to Object
_parent_block: refers to self
Methods Attached to Object
Source code in FoSpy/blocks/blocks.py
_meta_to_front
Moves metadata to the front of _key_order. Metadata will always be
serialized first, but being elsewhere in the order leads to unexpected
results when moving other keys to desired indices.
Source code in FoSpy/blocks/blocks.py
_rename_validators
Realigns any renamed attributes with their expected validator.
Parameters:
| Name | Type | Description | Default |
|---|---|---|---|
validators
|
dict
|
A dictionary mapping attribute names to validators, returned by
either
|
required |
Source code in FoSpy/blocks/blocks.py
_resolve_relative_path
Resolves a relative object path string into an object or function.
Example:
Source code in FoSpy/blocks/blocks.py
add_all_calc_routines
Schedule all available calculation routines.
Adds all available calc_routines to self._calc_routines using
list_avail_routines()
and
add_calc_routine().
Parameters:
| Name | Type | Description | Default |
|---|---|---|---|
recursive
|
bool
|
Optional recursion. See |
False
|
Source code in FoSpy/blocks/blocks.py
add_block
Adds an unexpected attribute with a validator mapped by type_alias.
Unexpected attributes not requiring a validator can be set directly
without using this method.
Parameters:
| Name | Type | Description | Default |
|---|---|---|---|
block_name
|
str
|
new unexpected attribute name |
required |
type_alias
|
str
|
Alias mapped to the desired validator in
|
required |
Source code in FoSpy/blocks/blocks.py
add_calc_comment
Add a calculated comment to be injected during serialization.
WARNING: This function can leave outdated calculations in comments after
serialization. Recommended to use add_calc_routine() instead.
Calculated comments are for user information and will be formatted to be skipped by the parser when reading the file. This is useful for comments that should be recalculated and refreshed during saving/serialization, like weight percentages or summaries.
Parameters:
| Name | Type | Description | Default |
|---|---|---|---|
key
|
str
|
attribute to attach the calculated comment to. Comments appear above their attached attributes in FOS format. |
required |
comment
|
str
|
comment text without comment formatting (don't include // or !) |
required |
calc_id
|
str
|
unique identifier for the calculated comment. If it matches an existing comment (like when refreshing a value), the comment is overwritten |
required |
Source code in FoSpy/blocks/blocks.py
add_calc_routine
Schedules a calculated comment.
Appends a
_calc_routine()-decorated
function to self._calc_routines to be run at
serialization.
Used to add calculated comments that should be refreshed during serialization.
Parameters:
| Name | Type | Description | Default |
|---|---|---|---|
path
|
str
|
a relative path string that can be resolved into a
|
required |
**kwargs
|
any
|
optional key word arguments to be passed to the function at path. |
{}
|
Raises:
| Type | Description |
|---|---|
TypeError
|
the attr or method at path is not registered as a _calc_routine |
Example:
mySyn.add_calc_routine("materials.add_weight_pcts", typ="reagent")
## mySyn.materials.add_weight_pcts(typ="reagent") is now scheduled
## to run at serialization
Source code in FoSpy/blocks/blocks.py
add_comments
Default behavior to be overwritten when attached to a parent block.
If a SingleBlock is stored as an attribute of another SingleBlock,
this method will be overwritten by the parent's __setattr__.
Source code in FoSpy/blocks/blocks.py
build_req_validators
classmethod
Builds required keys and validators mapped to subclass.
Walks all parent classes and builds a map of all keys that are required
during __init__, and their respective validation routines. Subclasses
are mapped to expected keys and validations in
parsing.validation. Subclass validations
override parent classes when applicable.
Returns:
| Name | Type | Description |
|---|---|---|
merged |
dict
|
Maps required keys to validation routines. Routines may be a class constructor or a func taking one arg. |
Example:
>>> SingleBlock.build_req_validators()
{
"name": str,
"type": str,
"formula": ChemFormula, # class constructor
"supplier": str,
"cas": str,
"form": str,
"env": str,
"ratio": validators.material.ratio # validator function
}
Source code in FoSpy/blocks/blocks.py
build_validators
classmethod
Builds expected keys and validators mapped to subclass.
Walks all parent classes and builds a map of all keys that are expected
(required or optional), and their respective validation routines.
Subclasses are mapped to keys and validations in
parsing.validation. Subclass validations
override parent classes when applicable.
Source code in FoSpy/blocks/blocks.py
clear_all_comments
clear_comments
copy
Returns a deep-copy of self by serializing and reconstructing.
_calc_comments are not preserved during copy, but _calc_routines are. This prevents mutation of the comments when reconstructing.
Source code in FoSpy/blocks/blocks.py
default_key_order
Set to default attribute order for serialization.
Rearrange attribute order to the default order assigned by
build_validators
Parameters:
| Name | Type | Description | Default |
|---|---|---|---|
deep
|
bool
|
When true, recursively calls |
False
|
Source code in FoSpy/blocks/blocks.py
dispatch_subclass
classmethod
Recommended dispatcher to allow subclass delegation when constructing.
Overridden in some subclasses, usually to assign subclass based on the value of one or more properties.
Default behavior passes blockDict and **kwargs to __init__
constructor.
Source code in FoSpy/blocks/blocks.py
get_req_validators
Overrides class validators with any renamed properties.
Similar to class method:
build_req_validators,
but uses
_rename_validators
to align any renamed properties with their original validators.
Source code in FoSpy/blocks/blocks.py
get_validators
Overrides class validators with any renamed properties.
Similar to class method:
build_validators,
but uses
_rename_validators
to align any renamed properties with their original validators. Also
adds any optional key overrides added by key$alias syntax.
Returns:
| Name | Type | Description |
|---|---|---|
vals |
dict
|
maps expected keys to validation routines. |
Source code in FoSpy/blocks/blocks.py
key_to_idx
Reorder attributes for serialization.
Move any attribute name to a specific index in _key_order for
serialization order. The invisible "metadata" key is always refreshed
to the front of the list, so indices are effectively 1-based.
Parameters:
| Name | Type | Description | Default |
|---|---|---|---|
key
|
str
|
name of attribute to reorder |
required |
idx
|
int
|
new index in _key_order |
required |
Source code in FoSpy/blocks/blocks.py
keys_to_end
Reorder attributes for serialization.
Move any attribute names in *args to the end of _key_order to be
serialized last. Order within *args is maintained in result.
Source code in FoSpy/blocks/blocks.py
keys_to_front
Reorder attributes for serialization.
Move any attribute names in *args to the front of _key_order to be
serialized first. Order within *args is maintained in result.
Source code in FoSpy/blocks/blocks.py
list_avail_routines
Lists all calc routines available to be added to self._calc_routines.
Non-abbreviated calc routine strings can be passed directly to
self.add_calc_routine()
Parameters:
| Name | Type | Description | Default |
|---|---|---|---|
recursive
|
bool
|
If True, recursively walks all attributes and appends results
from |
False
|
prefix
|
str
|
Used during recursion to build relative paths |
''
|
abbreviated
|
bool
|
optionally abbreviate recursively repeated routines for similar
objects into one line. This line cannot be passed to
|
False
|
Returns:
| Name | Type | Description |
|---|---|---|
routines |
list
|
list of strings describing _calc_routine-decorated methods.
Non-abbreviated calc routine strings can be passed directly to
|
Example:
mySyn.list_avail_routines()
## returns []
mySyn.list_avail_routines(recursive=True)
## returns [
## 'reaction.add_nom_MW',
## 'materials.add_weight_pcts',
## 'materials[0].add_MW',
## 'materials[1].add_MW',
## ... 6 total materials with the same calc_routine
## 'materials[5].add_MW'
## ]
mySyn.list_avail_routines(recursive=True, abbreviated=True)
## returns [
## 'reaction.add_nom_MW',
## 'materials.add_weight_pcts',
## 'materials[i].add_MW; i = [0, 1, 2, 3, 4, 5]'
## ]
Source code in FoSpy/blocks/blocks.py
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make_template
Converts self into a template of its original subclass.
Returns a copy of self as a template of its original subclass, with
specified fields replaced with template types. See
TemplateClass for
more information on template generation.
Parameters:
| Name | Type | Description | Default |
|---|---|---|---|
template_name
|
str
|
All templates require an identifying name. |
required |
*args
|
str
|
properties to clear and replace with template types. |
()
|
Source code in FoSpy/blocks/blocks.py
reflex
classmethod
Generate a flexible template for the current class.
Flexibly generates a template for the current class where any required
properties missing from kwargs are automatically converted to template
types (See
FlexTemplate).
Returns an instance of the flexible template constructed from kwargs,
or a serial dictionary of that instance.
Parameters:
| Name | Type | Description | Default |
|---|---|---|---|
serialize
|
bool
|
Whether to return the serialized dictionary of the reflexed template, or the object itself. |
True
|
**kwargs
|
str
|
Known properties to pass to the template constructor. |
{}
|
Source code in FoSpy/blocks/blocks.py
refresh_attachments
Source code in FoSpy/blocks/blocks.py
rename_block
Source code in FoSpy/blocks/blocks.py
serialize
Return a recursively serialized dict representation of self.
Fully serialized SingleBlocks are a single dict that can be passed to
another constructor or emitted into lines for a FOS file. Serialized
values at any nest level are either dicts, lists, or strings to allow
full type-coersion when reconstructing or simplified emission when
writing files.
Serialized dict is deep copied to prevent object mutation.
Parameters:
| Name | Type | Description | Default |
|---|---|---|---|
keepListType
|
bool
|
When True, maintains its current FOS printing mode (looped keys or explicit key:value lines), instead of explicit default |
False
|
shallow
|
bool
|
When True, no recursive serialization occurs. Recommended when serialization is used only to inspect top-level keys. |
False
|
clean
|
bool
|
When True, no FOS format read/write metadata is included in the serial. Recommended for sending output to other formats like JSON. |
False
|
Private attributes starting with "_" are either skipped or unpacked in special cases:
-
_key_order: attributes are added to the serialized dict in the order they appear in this list. -
_calc_comments: calculated comments are attached to their mapped attribute after serialization to avoid mutation of object comments -
_calc_routines: A list of functions scheduled to be called right before serialization to update _calc_comments. Scheduling calc routines ensures that their calculated values are up-to-date. -
_meta: attributes of this container are given their own private_keys mapped byFoSpy.parsing.syntax.meta_keysin the serialized dict. -
_key_overrides: per-instance override mapping that tracks which unexpected attributes require $alias suffixes. -
_aliases: maps attribute names to alias tags used to emit $alias suffixed keys. -
_reserved: attribute names in reserved are non-private attributes which should not be serialized. This usually applies to theextattribute or methods attached after construction.
Source code in FoSpy/blocks/blocks.py
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to_json
Converts self into a JSON-formatted string or file.
Serializes and either returns as a JSON-formatted string or saves to a JSON file.
Parameters:
| Name | Type | Description | Default |
|---|---|---|---|
filepath
|
pathlike
|
JSON file save destination. If |
None
|
clean
|
bool
|
When True, no FOS format read/write metadata is included in the serial. FOS metadata has no impact on JSON format but may be useful to view in JSON for troubleshooting. |
True
|
indent
|
int
|
|
4
|
**kwargs
|
any
|
other arguments passed to |
{}
|