Monte Carlo Conformational Search: Difference between revisions
Jump to navigation
Jump to search
New page: Here follows some useful tips when performing a Monte Carlo conformational search: * "man kann doch die Manual lesen" (German for "you can read the manual") * When selecting torsions to ... |
No edit summary |
||
| Line 3: | Line 3: | ||
* "man kann doch die Manual lesen" (German for "you can read the manual") | * "man kann doch die Manual lesen" (German for "you can read the manual") | ||
* When selecting torsions to vary, the second atom in the torsion specification must not be connected to a frozen atom | * When selecting torsions to vary, the second atom in the torsion specification | ||
must not be connected to a frozen atom | |||
Revision as of 17:13, 16 February 2010
Here follows some useful tips when performing a Monte Carlo conformational search:
- "man kann doch die Manual lesen" (German for "you can read the manual")
- When selecting torsions to vary, the second atom in the torsion specification
must not be connected to a frozen atom