Name | Version | Summary | date |
---|---|---|---|
dspawpy | 1.5.4 | Tools for dspaw | 2024-07-05 05:30:50 |
dxtb | 0.0.1 | Fully Differentiable Approach to Extended Tight Binding | 2024-06-30 10:17:50 |
tad-mctc | 0.2.0 | Torch Autodiff Utility | 2024-06-26 12:41:39 |
packaging-extrapolation | 1.1.0 | Extrapolation methods for complete basis sets | 2024-06-18 08:39:20 |
psi4-step | 2024.5.23.3 | A SEAMM plug-in to setup, run and analyze quantum chemistry calculations using Psi4 | 2024-05-23 23:05:38 |
qmllib | 1.0.1 | Python/Fortran toolkit for representation of molecules and solids for machine learning of properties of molecules and solids. | 2024-03-29 20:19:01 |
hour | day | week | total |
---|---|---|---|
37 | 1889 | 9326 | 224543 |