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Can we trust docking results?
Sept 2010

IBM Systems and Technology Group releases a white paper with eHiTS and Cell
Oct 2008

EPA's ToxCastTM project will use SimBioSys' eHiTS as docking engine
Nov, 2007

[Events]

243rd ACS
Mar 25-29, 2012
San Diego, CA
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Index

SimBioSys' products related presentation at the:  

Spring 2009 ACS National Meeting & Exposition


to be held in Salt Lake City, UT, Mar 22 - 26, 2009




  1. COMP 1
    Session: Advancing Computational Chemistry through High-Performance Computing: From the Workstation to Petascale and Beyond: Michael Dewar Memorial Symposium

    Sunday, March 22, 2009 from 8:30 AM to 9:10 AM; SPCC -- 257, Oral
    "Docking performance accelerated 30-50 fold on the Cell/BE processor"
    Presenter: Zsolt Zsoldos, view abstract view: presentation

  2. CINF 044
    SESSION: Library Design, Search Methods and Applications of Fragment-based Drug Design

    Tuesday, March 24, 2009 from 10:10 AM to 10:40 AM; SPCC -- 254 A, Oral
    "Fragment based docking and linking engine of eHiTS"
    Presenter: Zsolt Zsoldos, view: abstract view: presentation

  3. CINF 063
    SESSION: Adaptive Scoring Functions

    Wednesday, March 25, 2009 from 10:00 AM to 10:35 AM; SPCC -- 254 A, Oral
    "eHiTS scoring function"
    Presenter: Zsolt Zsoldos, view abstract view: presentation

  4.  COMP 208
    SESSION: Drug Discovery
    Thursday, March 26, 2009 from 8:30 AM to 9:00 AM; SPCC -- 258, Oral
    "eHiTS: Docking and scoring ligand/target interactions to give good score-rmsd and ic50 correlations in in silico high throughput screening"
    Presenter: Danni Harris, view abstract view: presentation

  5.  CINF 033
    "Computational tools for fragment based drug design"
    Monday, March 23, 2009 Salt Palace Convention Center -- 254 A, Oral; 1:35 PM
    Presenter: A. Peter Johnson, view abstract view: presentation

  6.  COMP 214
    Computational approaches to antibacterial and antimalarial hit finding"

    Thursday, March 26, 2009 Salt Palace Convention Center -- 257, Oral, 1:00 PM
    Presenter: A. Peter Johnson, view abstract

  7.  CINF 073
    "Scoring synthetic feasibility: A very different problem"
    Wednesday, March 25, Salt Palace Convention Center -- 254 A, Oral, 4:05 PM
    Presenter: A. Peter Johnson, view abstract, view presentation

All SimBioSys Spring ACS, 2009 presentations:

[1], [2], [3], [4], [5], [6]. [7]

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