Topics in BioGeometry web: Changed: now 01:06 Changed by:
DarpaFL06 15 Mar 2006 - 10:32 - NEW JackSnoeyink
Please add your information or email me (snoeyink@cs.unc.edu) to add it. The meeting will take place at the Cheeca Lodge in Islamorada, Florida, on Tuesday, Wednesday ...  
EventsArchive 04 Feb 2005 - 13:09 - NEW JackSnoeyink
A place to paste expired events. Main.JackSnoeyink 04 Feb 2005  
EventsCalendar 26 Apr 2006 - 15:43 - r1.11 JackSnoeyink
Please visit previous revision. TOC Please add events, or move expired events to Main.EventsArchive. Speakers WEDNESDAY, APRIL 26 "Structural Investigations of Protein ...  
ExplicitWaterRefactor 11 Jul 2005 - 15:44 - NEW AndrewLeaverFay
Main.AndrewLeaverFay 11 Jul 2005 Rosetta adds extra rotamers with explicitly attached water molecules. These rotamers duplicate side chain dihedrals / atom coordinates ...  
HbondPapers 21 Jul 2009 - 18:56 - r1.3 JackSnoeyink
TOC Misc papers on hydrogen bonds Ask me for any papers that aren't already linked/attached. Link back to: RosettaHydrogenBonds Survey E. N. BAKER and R. E. HUBBARD ...  
ImpliedHinges 24 Jun 2005 - 13:47 - r1.7 AndreaMantler
We say that a graph G satisfies a Laman condition for 3d if every induced subgraph (V,E) with V 2 satisfies 3 V 6 E . Jacobs claimed that a graph was rigid in 3d if ...  
ImproveHbonds 26 Mar 2005 - 13:00 - r1.2 JackSnoeyink
TOC Here are some ways to improve hbonds.cc from OptimizingRosetta. hbonds.cc: original hbonds.cc The energy function The function used comes from Kortemme et al ...  
LiteratureReviews 07 Sep 2005 - 17:59 - r1.11 XueyiWang
TOC RNA Secondary Structure Prediction The problem of predicting the RNA Secondary Structure without pseudoknots is well-resolved 1-6 , with time O(n3) and space ...  
MatlabScripts 04 Feb 2005 - 14:58 - NEW JackSnoeyink
Here are some things that we have written in MATLAB for working with protein structures. PdbTools read pdb files, do Ramachandran plots, rmsd, etc. Idiosyncratic, ...  
MolecularDrivingForces 27 May 2005 - 12:18 - r1.2 JackSnoeyink
I've recently obtained the book "Molecular Driving Forces" by Dill Bromberg, which introduces statistical thermodynamics and all the associated mathematics. It is ...  
OpenProblems 22 Feb 2005 - 10:33 - r1.2 JackSnoeyink
Main.AndrewLeaverFay 21 Feb 2005 Rotamer Energy Calculation Problem: minimize the number of additions and table-look-ups in calculating the pair interaction energy ...  
OptE 04 Feb 2009 - 17:03 - r1.2 MatthewOmeara
A protocol for fitting the weights of the energy function Documentation for OptE INTRODUCTION OptE is a protocol for optimizing the weights of the score function for ...  
OptEOnTopsail 11 Feb 2009 - 18:00 - r1.8 MatthewOmeara
UNC getting started on Topsail page http://help.unc.edu/6214 Load the gcc development suit module module load hpc/mvapich-gcc get mini source onto the scratch partition ...  
OptimizingRosetta 23 Nov 2005 - 16:45 - r1.5 JackSnoeyink
Here are some ideas for optimizing Rosetta, with links to new pages for the ones that we actually experiment on, or carry out. RotamerTrie store rotamer sets in a ...  
PdbTools 04 Feb 2005 - 15:03 - NEW JackSnoeyink
a collection of matlab functions to read proteins from pdb format and calculate parameters. pdbread read a pdb file with optional het atoms selectAmino chooses just ...  
ProjectIdeas 02 Sep 2005 - 13:27 - r1.5 JackSnoeyink
This is a place to jot down project ideas, and link to WikiWords for projects where the ideas are more fleshed out. OptimizingRosetta for ideas specifically pertaining ...  
ProteinVoid 23 Nov 2005 - 16:53 - NEW JackSnoeyink
TOC Estimating protein void volumes Question: is it worthwhile putting in an estimate of the void volume as part of the energy function for optimizing rotamer choices ...  
R6Solver 04 Feb 2005 - 15:06 - NEW JackSnoeyink
Using Manocha's 6dof solver for protein backbone manipulation. Main.JackSnoeyink 04 Feb 2005 r6solver.zip: Dump of all tools in directory no warranty  
ResearchIdeasJotPad 21 Jul 2009 - 18:19 - NEW JackSnoeyink
Place to jot ideas Plot percentage of density to evaluate which candidates really ore H bonds. Measure lengthen of bifurcated bonds. Correlate H bond lengths at surface ...  
RigidityQuestions 14 Jun 2005 - 09:26 - NEW JackSnoeyink
Here are some rigidity questions that we are working on: ProteinAllostery: can rigidity analysis for some set of bonds give a model for an allosteric interaction in ...  
RosettaHydrogenBonds 21 Jul 2009 - 18:16 - r1.6 JackSnoeyink
Running OptE on UNC clusters: OptEOnTopsail OptEOnBass HbondPapers ResearchIdeasJotPad Previous work by Chris Sheldahl: Main.ChrisProgress Implemented ideas to ImproveHbonds ...  
RosettaMeetings 29 Nov 2005 - 21:56 - r1.5 JackSnoeyink
TOC Planned meetings 6 Dec: Glenn Butterfoss Brian Kuhlmann, more on protein voids Past meetings 22 Nov: Craig Bennetts Jack Snoeyink, estimating protein voids We ...  
RotamerEnergyCalculation 02 Apr 2005 - 13:21 - NEW JackSnoeyink
This question is partially addressed in RotamerTrie Main.JackSnoeyink 02 Apr 2005 Rotamer Energy Calculation Main.AndrewLeaverFay 21 Feb 2005 Problem: minimize ...  
RotamerTrie 13 Apr 2005 - 09:59 - r1.7 JackSnoeyink
A topic under OptimizingRosetta TOC We should try to submit to WABI, April 20. This will take some work... The basic idea is described in Hellinga's paper, so we need ...  
RotamerWaters 05 Sep 2008 - 20:51 - NEW JackSnoeyink
Phil Bradley has done some preliminary work on including explicit waters into rosetta. I will begin by looking at his work with the goal of being able to present ...  
SiteTools 03 Jul 2008 - 15:22 - NEW ChristianStith
Site Tools of the BioGeometry Web INCLUDE{" TWIKIWEB .WebSiteTools"} Notes: INCLUDE{" TWIKIWEB .YouAreHere"} Main.ChristianStith 03 Jul 2008  
SpeedSimulatedAnnealing 25 Apr 2005 - 13:59 - NEW AndrewLeaverFay
Main.AndrewLeaverFay 25 Apr 2005 In the rotamer substitution step of simulated annealing, Rosetta calculates the energy difference a rotamer substitution would ...  
SuperRotamers 04 Jan 2006 - 22:24 - NEW JackSnoeyink
These are the backbone residues Brian Kuhlman suggested for modification in the meeting of Jan 4, 2006. The pdb files and PyMol scenes are in designDecoyResidueSelections ...  
UseInitializers 13 Apr 2005 - 10:10 - NEW JackSnoeyink
http://msdn.microsoft.com/library/en-us/vccelng/htm/ators 17.asp http://www.devx.com/getHelpOn/Article/16039/1954?pf true Main.JackSnoeyink 13 Apr 2005  
WebChanges 16 Aug 2001 - 19:58 - NEW PeterThoeny
INCLUDE{" TWIKIWEB .WebChanges"}  
WebHome 04 Feb 2009 - 16:11 - r1.15 MatthewOmeara
The Biogeometry wiki is a collection of random pages from those of use here at UNC Computer Science who are interested in geometric problems arising in structural ...  
WebIndex 24 Nov 2001 - 11:41 - r1.2 PeterThoeny
SEARCH{"\. " scope "topic" regex "on" nosearch "on"} See also the faster WebTopicList  
WebLeftBar 04 Feb 2005 - 13:48 - r1.2 JackSnoeyink
INCLUDINGWEB Web INCLUDINGWEB Web Home Events Main.ProgressReports Changes Index Search Webs WEBLIST{" $name" separator ""} INCLUDE{" MAINWEB . WIKINAME LeftBar" ...  
WebNotify 28 Aug 2004 - 07:30 - r1.4 PeterThoeny
This is a subscription service to be automatically notified by e-mail when topics change in this BioGeometry web. This is a convenient service, so you do not have ...  
WebPreferences 28 Jan 2009 - 19:17 - r1.12 JackSnoeyink
BioGeometry Web Preferences The following settings are web preferences of the BioGeometry web. These preferences overwrite the site-level preferences in TWIKIWEB ...  
WebRss 16 Aug 2004 - 03:27 - r1.2 PeterThoeny
TWiki's BioGeometry web SCRIPTURL /view SCRIPTSUFFIX /BioGeometry The BioGeometry web of TWiki. TWiki is a Web-Based Collaboration Platform for the Corporate World ...  
WebSearch 08 Aug 2001 - 05:26 - NEW PeterThoeny
INCLUDE{" TWIKIWEB .WebSearch"}  
WebSearchAdvanced 18 Jan 2004 - 10:52 - NEW PeterThoeny
INCLUDE{" TWIKIWEB .WebSearchAdvanced"}  
WebStatistics 02 Aug 2024 - 22:15 - r1.13 Main.guest
Statistics for BioGeometry Web Month: Topic views: Topic saves: File uploads: Most popular topic views: Top contributors for topic save and uploads: Aug 2024 412 ...  
WebTopicList 24 Nov 2001 - 11:40 - NEW PeterThoeny
TOPICLIST{" $name "} See also the verbose WebIndex.  
WellSeparatedPairDecomposition 28 Apr 2005 - 21:16 - NEW JackSnoeyink
I presented Sariel Har-Peled's slides on well-separated pair decompositions in group meeting today. They have links to Callahan Kosaraju's paper. See also the Multipole ...  

Number of topics: 41

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Revision: r1.1 - 03 Feb 2005 - 22:01 - Main.guest
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