Name | Version | Summary | date |
---|---|---|---|
firecode | 1.1.0 | Computational chemistry general purpose ensemble optimizer and transition state builder | 2024-12-24 11:55:43 |
dxtb | 0.1.1 | Fully Differentiable Approach to Extended Tight Binding | 2024-10-21 18:46:06 |
tscode | 0.4.16 | Computational chemistry general purpose transition state builder and ensemble optimizer | 2024-04-02 17:44:21 |
hour | day | week | total |
---|---|---|---|
75 | 1745 | 10294 | 303441 |