2 unstable releases

0.2.0 Feb 26, 2023
0.1.0 Nov 9, 2022

#448 in Science

MIT license

66KB
2K SLoC

CTcore

CTcore is a suite of precision tools for reading and ultimately writing the CTfile family of formats found throughout computational chemistry and cheminformatics. For details, see Reading CTfiles with CTcore.

CTfile Documentation

The CTfile format is documented as follows:

Test Suite

Runt the test suite:

cargo t --all

Versions

CTcore is not yet stable. Patch versions never introduce breaking changes, but minor/major versions probably will.

CTcore is distributed under the terms of the MIT License. see LICENSE and COPYRIGHT for details.

No runtime deps