More specific crashes on 1573 - score issue

Case number:	699969-2005714
Topic:	General
Opened by:	wisky
Status:	Open
Type:	Suggestion
Opened on:	Saturday, September 15, 2018 - 07:14
Last modified:	Saturday, September 15, 2018 - 07:33

My completely redesigned molecule will not wiggle above my current high score. whenever it tries to pass it, the client crashes as described by numerous other comments.

(Sat, 09/15/2018 - 07:14 | 1 comment)

3 Up Down

Sat, 09/15/2018 - 07:33

wisky 89 2536

Offline

Joined: 07/13/2011

Groups: Anthropic Dreams

Here are my "crash conditions" that I've come across so far. Turning the filters on and off does not affect crash rates.

Guaranteed crash (100% of the time)
-Try to score higher than my current best (18895). Client immediately crashes when attempting to go higher than that.

Highly Likely crash (~35% of edits)
-editing the ligand

Likely crash (~5% of operations)
-MMFF Wiggle
-Wiggle Sidechains
-Shake Sidechains
-Wiggle All
-Wiggle Backbone
-Pull
-Any of the above with bands on

Low Likely crash (~1% of operations)
-Move
-Wiggle/shake, excluding ligand.

So basically, I (and probably most others too) can't: Edit, optimize, or position on this puzzle without it crashing.

In other words: This puzzle is broken and needs fixing.