There are two new tutorials on REST (@zhang-ivy) and Umbrella sampling (@sef43); and a new cookbook entry on computing interaction energies (@peastman).
What's Changed
- Add tutorial for running REST by @zhang-ivy in #17
- minor formatting changes by @sef43 in #20
- Not only querying, but also modifying system parameters by @yuanqing-wang in #18
- Add CI test for building the website with sphinx by @sef43 in #25
- Cookbook entry on computing interaction energies by @peastman in #26
- add umbrella sampling tutorial by @sef43 in #24
- remove large output by @sef43 in #27
New Contributors
- @zhang-ivy made their first contribution in #17
- @yuanqing-wang made their first contribution in #18
Full Changelog: v0.2...v0.3
Contributors
peastman, sef43, and 2 other contributors