Commit Graph

22 Commits

Author SHA1 Message Date
b7e5f7c002 Finished data management example 2024-02-19 15:28:38 +01:00
55ad026e7b Worked out example for static properties 2024-02-10 14:53:47 +01:00
7231dc53fd Worked out example for dynamic properties 2024-02-10 14:53:35 +01:00
6b99ed67ff Updated free_energy_landscape.py to reflect code changes in mdevaluate 2024-02-10 13:48:58 +01:00
a0e13b8f1f Added example for vectors 2024-02-02 16:53:43 +01:00
30d823e3b1 Finished subset example 2024-02-02 13:28:53 +01:00
9bf00254af Started example for static properties 2024-01-27 14:54:04 +01:00
41ffe0c829 Started example for dynamic properties 2024-01-27 14:53:53 +01:00
39a24555e8 Merge remote-tracking branch 'origin/main' 2024-01-27 14:51:52 +01:00
e0a40bae01 Started example for data management calculations 2024-01-27 14:51:48 +01:00
678b2bd25c Started example for data management calculations 2024-01-27 14:51:19 +01:00
d91f797495 Started example for free energy landscape calculations 2024-01-27 14:49:58 +01:00
5fab24877d Added example for multi selector 2024-01-27 13:00:24 +01:00
8c246af1b5 Added example for single selector 2024-01-20 12:52:30 +01:00
0f6f293090 Moved file into a separate folder 2024-01-20 10:12:47 +01:00
83e9398a58 Removed folder 2024-01-20 10:06:46 +01:00
add1fe5f8c Started selector example 2024-01-19 17:12:39 +01:00
f1bfefb193 Updated .gitignore 2024-01-19 13:38:25 +01:00
c06e1ebfba Updated README.md 2024-01-19 13:36:58 +01:00
7a777ee2fc Updated LICENSE 2024-01-19 13:36:49 +01:00
fdf4c17392 Added .gitignore 2024-01-19 08:59:35 +01:00
b6c352392d Initial commit 2024-01-18 15:57:36 +00:00