MOPAC is a computational chemistry software package that implements a variety of semi-empirical quantum chemistry methods based on the neglect of diatomic differential overlap (NDDO) approximation and fit primarily for gas-phase thermochemistry
| Package Version | Update ID | Released | Package Hub Version | Platforms | Subpackages |
|---|---|---|---|---|---|
| 23.1.2-bp160.1.12 info | GA Release | 2025-03-13 | 16.0 |
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