{"id":88,"date":"2011-07-12T08:35:07","date_gmt":"2011-07-12T08:35:07","guid":{"rendered":"http:\/\/www.ukqsar.org\/?p=88"},"modified":"2011-07-12T08:35:07","modified_gmt":"2011-07-12T08:35:07","slug":"spring-meeting-2006","status":"publish","type":"post","link":"https:\/\/ukqsar.org\/index.php\/2011\/07\/12\/spring-meeting-2006\/","title":{"rendered":"Spring Meeting 2006"},"content":{"rendered":"<h1>Accelrys<br \/>\nCambridge, UK<\/h1>\n<h2>Presentations<\/h2>\n<ul>\n<li><strong>Nico Adams<\/strong>\u00a0(University of Cambridge, UK)<br \/>\nPredicting Thermochemical Parameters of Oxygen-containing Heterocycles using simple QSPR models<\/li>\n<li><strong>Mohammad Afshar<\/strong>\u00a0(Ariana Pharma, France)<br \/>\nRule-based multi-objective decision support: a new paradigm for structure activity analysis and prediction<\/li>\n<li><strong>Daniel Almonacid<\/strong>\u00a0(Unilever Centre for Molecular Informatics, University of Cambridge, UK)<br \/>\nMACiE v2: Towards Understanding the Repertoire of Enzyme Catalysis<\/li>\n<li><strong>Remy Hoffmann and Richard Compton<\/strong>\u00a0(Accelrys, UK)<br \/>\nWelcome<\/li>\n<li><strong>Robert Glenn<\/strong>\u00a0(Unilever Centre for Molecular Sciences Informatics, Cambridge, UK)<br \/>\nVirtual screening: The King (quite often) has no clothes [<a href=\"http:\/\/www.ukqsar.org\/slides\/bobby_glen2006.pdf\">Slides<\/a>]<\/li>\n<li><strong>Mike Hann<\/strong>\u00a0(GSK, UK)<br \/>\nComputational Chemistry &#8211; twenty odd years of what we still can&#8217;t do [<a href=\"http:\/\/www.ukqsar.org\/slides\/mike_hann2006.pdf\">Slides<\/a>]<\/li>\n<li><strong>David Palmer<\/strong>\u00a0(University of Cambridge, UK)<br \/>\nNovel Methods for the Prediction of Solubility<\/li>\n<li><strong>Dave Ritchie<\/strong>\u00a0(University of Aberdeen, UK)<br \/>\nProtein Docking and Molecular Shape Recognition using Polar Fourier Correlations [<a href=\"http:\/\/www.ukqsar.org\/slides\/dave_ritchie2006.pdf\">Slides<\/a>] [<a href=\"http:\/\/www.ukqsar.org\/slides\/dave_ritchie2006a.pdf\">Slides<\/a>]<\/li>\n<li><strong>Andy Davis and Sarah Rodgers<\/strong>\u00a0(AstraZeneca, UK)<br \/>\nADME QSAR &#8211; Further Experiences of a Chemical Fortune-teller<\/li>\n<\/ul>\n<h2>Abstracts<\/h2>\n<h3>Presentation: Nico Adams<br \/>\nPredicting Thermochemical Parameters of Oxygen-containing Heterocycles using simple QSPR models<\/h3>\n<p><em>University of Cambridge, UK<\/em><\/p>\n<p>HASH(0x3619714)<\/p>\n<h3>Presentation: Mohammad Afshar<br \/>\nRule-based multi-objective decision support: a new paradigm for structure activity analysis and prediction<\/h3>\n<p><em>Ariana Pharma, France<\/em><\/p>\n<p>HASH(0x366f430)<\/p>\n<h3>Presentation: Daniel Almonacid<br \/>\nMACiE v2: Towards Understanding the Repertoire of Enzyme Catalysis<\/h3>\n<p><em>Unilever Centre for Molecular Informatics, University of Cambridge, UK<\/em><\/p>\n<p>HASH(0x3619468)<\/p>\n<h3>Presentation: Remy Hoffmann and Richard Compton<br \/>\nWelcome<\/h3>\n<p><em>Accelrys, UK<\/em><\/p>\n<p>HASH(0x3616498)<\/p>\n<h3>Presentation: Robert Glenn<br \/>\nVirtual screening: The King (quite often) has no clothes<\/h3>\n<p><em>Unilever Centre for Molecular Sciences Informatics, Cambridge, UK<\/em>\u00a0[<a href=\"http:\/\/www.ukqsar.org\/slides\/bobby_glen2006.pdf\">Slides<\/a>]<\/p>\n<p>HASH(0x3618b44)<\/p>\n<h3>Presentation: Mike Hann<br \/>\nComputational Chemistry &#8211; twenty odd years of what we still can&#8217;t do<\/h3>\n<p><em>GSK, UK<\/em>\u00a0[<a href=\"http:\/\/www.ukqsar.org\/slides\/mike_hann2006.pdf\">Slides<\/a>]<\/p>\n<p>HASH(0x3616564)<\/p>\n<h3>Presentation: David Palmer<br \/>\nNovel Methods for the Prediction of Solubility<\/h3>\n<p><em>University of Cambridge, UK<\/em><\/p>\n<p>HASH(0x3618e44)<\/p>\n<h3>Presentation: Dave Ritchie<br \/>\nProtein Docking and Molecular Shape Recognition using Polar Fourier Correlations<\/h3>\n<p><em>University of Aberdeen, UK<\/em>\u00a0[<a href=\"http:\/\/www.ukqsar.org\/ukqsar\/meetings\/ARRAY(0x3475c48)\">Slides<\/a>]<\/p>\n<p>HASH(0x36190f0)<\/p>\n<h3>Presentation: Andy Davis and Sarah Rodgers<br \/>\nADME QSAR &#8211; Further Experiences of a Chemical Fortune-teller<\/h3>\n<p><em>AstraZeneca, UK<\/em><\/p>\n<p>HASH(0x3618898)<\/p>\n","protected":false},"excerpt":{"rendered":"<p>Accelrys Cambridge, UK Presentations Nico Adams\u00a0(University of Cambridge, UK) Predicting Thermochemical Parameters of Oxygen-containing Heterocycles using simple QSPR models Mohammad<\/p>\n","protected":false},"author":15,"featured_media":0,"comment_status":"open","ping_status":"open","sticky":false,"template":"","format":"standard","meta":{"_jetpack_newsletter_access":"","_jetpack_dont_email_post_to_subs":false,"_jetpack_newsletter_tier_id":0,"_jetpack_memberships_contains_paywalled_content":false,"_jetpack_feature_clip_id":0,"_jetpack_memberships_contains_paid_content":false,"footnotes":"","jetpack_post_was_ever_published":false},"categories":[4],"tags":[],"class_list":["post-88","post","type-post","status-publish","format-standard","hentry","category-meetings"],"aioseo_notices":[],"aioseo_head":"\n\t\t<!-- All in One SEO 5.0.1.1 - aioseo.com -->\n\t<meta name=\"robots\" content=\"max-image-preview:large\" \/>\n\t<meta name=\"author\" content=\"David Marcus\"\/>\n\t<link rel=\"canonical\" href=\"https:\/\/ukqsar.org\/index.php\/2011\/07\/12\/spring-meeting-2006\/\" \/>\n\t<meta name=\"generator\" content=\"All in One SEO (AIOSEO) 5.0.1.1\" \/>\n\t\t<meta 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