xyz-parse


Namexyz-parse JSON
Version 0.1.3 PyPI version JSON
download
home_pagehttps://github.com/aqora-io/xyz-parse
SummarySimple parser for the XYZ file format
upload_time2024-05-19 13:31:11
maintainerNone
docs_urlNone
authorJulian Popescu <jpopesculian@gmail.com>
requires_python>=3.8
licenseMIT OR Apache-2.0
keywords xyz chemistry parser parse
VCS
bugtrack_url
requirements No requirements were recorded.
Travis-CI No Travis.
coveralls test coverage No coveralls.
            # xyz-parse

A parser for the [XYZ file format](https://en.wikipedia.org/wiki/XYZ_file_format)

The formatting of the .xyz file format is as follows:

```rust
<number of atoms>
comment line
<element> <X> <Y> <Z>
...
```

Currently the parser does not support extended XYZ format, but may do so in the future


            

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