Differences

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--- events:2016_summer_school:qmmm [2018/05/29 22:03] – mwatkins
+++ events:2016_summer_school:qmmm [2020/08/21 10:15] (current) – external edit 127.0.0.1
@@ Line 84: / Line 84: @@
 Well known method is QMMM, one main strand arose from the bio community - aiming to accurately model active sites in proteins
-{{ exercises:2016_summer_school:rhodopsin.png?320}}
+{{exercises:2016_summer_school:rhodopsin.png?320}}
 typically the active site was surrounded by a finite number of classical point charges
@@ Line 96: / Line 96: @@
 An attractive feature of CP2K's QMMM implementation is that it can be fully periodic, or anything from a cluster to a 3D system.
-{{exercises:2016_summer_school:qmmm_island.png?320 | 3D system}}
+{{exercises:2016_summer_school:qmmm_island.png?320 | 3D system }}
 {{ exercises:2016_summer_school:qmmm_sandwich.png?320|2D sandwich system}}
@@ Line 233: / Line 232: @@
 ===== Input files =====
-Example setup for KCl that we used [here](https://onlinelibrary.wiley.com/doi/10.1002/jcc.23904/full).
+Example setup for KCl that we used [[https://onlinelibrary.wiley.com/doi/10.1002/jcc.23904/full| here]].
 {{https://onlinelibrary.wiley.com/store/10.1002/jcc.23954/asset/image_n/jcc23954-toc-0001.png?v=1&s=6f79087c34654bcc15eda422e9c03888b4ee9550}}