work
Description
Description
Details
Details
- Committed
puckvg Jan 6 2022, 15:18 - Pushed
puckvg Jan 6 2022, 15:18 - Parents
- R11301:9d7adea85e44: fix CM
- Branches
- Unknown
- Tags
Authored by puckvg on Jan 6 2022, 15:18.
Changes (22)
Changes (22)
| Path | ||||
|---|---|---|---|---|
| A | (dir) | .ipynb_checkpoints/ | ||
| P | .ipynb_checkpoints/GetCM-checkpoint.ipynb Copied from GetCM.ipynb | |||
| P | .ipynb_checkpoints/GetCMAmons-checkpoint.ipynb Copied from GetCMAmons.ipynb | |||
| P | .ipynb_checkpoints/GetFCHL-checkpoint.ipynb Copied from GetFCHL.ipynb | |||
| P | .ipynb_checkpoints/GetFCHLAmons-checkpoint.ipynb Copied from GetFCHLAmons.ipynb | |||
| P | .ipynb_checkpoints/GetSLATM-checkpoint.ipynb Copied from GetSLATM.ipynb | |||
| P | .ipynb_checkpoints/GetSLATMAmons-checkpoint.ipynb Copied from GetSLATMAmons.ipynb | |||
| P | .ipynb_checkpoints/GetSOAP-checkpoint.ipynb Copied from GetFCHL.ipynb | |||
| P | .ipynb_checkpoints/GetSOAPAmons-checkpoint.ipynb Copied from GetFCHLAmons.ipynb | |||
| A | .ipynb_checkpoints/GetaCM-checkpoint.ipynb | |||
| P | .ipynb_checkpoints/GetaCMAmons-checkpoint.ipynb Copied from GetaCMAmons.ipynb | |||
| P | .ipynb_checkpoints/xyz2sdf-checkpoint.ipynb Copied from xyz2sdf.ipynb | |||
| D | GetFunctionalGroups.ipynb | |||
| D | Project.aux | |||
| D | Project.log | |||
| D | Untitled.ipynb | |||
| D | functional_groups.txt | |||
| D | out_qm9.txt | |||
| D | out_vitc.txt | |||
| D | qm9_out.txt | |||
| D | vitc_opt.txt | |||
| D | vitc_out.txt |
R11301:1392955adabe
R11301:1392955adabe
c4science ยท Help