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OpenDAS
torchani
Commits
004f5a52bb28ee338f688148c3dfe7310d7c5c9f
Switch branch/tag
torchani
examples
vibration_analysis.py
08 Nov, 2019
1 commit
Use namedtuple to improve API while still maintaining backward compatibility (#380)
· 004f5a52
Gao, Xiang
authored
Nov 08, 2019
* Use namedtuple to improve API * improve
004f5a52
21 May, 2019
1 commit
Add vibrational mode support (#228)
· e88f6266
Gao, Xiang
authored
May 21, 2019
e88f6266
10 May, 2019
1 commit
Add support for analytical hessian and vibrational analysis (#222)
· 14d2ef70
Gao, Xiang
authored
May 10, 2019
14d2ef70
