Name | Version | Summary | date |
---|---|---|---|
dxtb | 0.1.0 | Fully Differentiable Approach to Extended Tight Binding | 2024-09-18 14:04:51 |
firecode | 1.0.0 | Computational chemistry general purpose ensemble optimizer and transition state builder | 2024-07-05 23:30:46 |
tscode | 0.4.16 | Computational chemistry general purpose transition state builder and ensemble optimizer | 2024-04-02 17:44:21 |
hour | day | week | total |
---|---|---|---|
46 | 1230 | 9910 | 250544 |