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	<title>Quantum Discovery Labs &#187; video</title>
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	<link>http://q-pharm.com</link>
	<description>The drug discovery company</description>
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		<title>Free energy perturbation theory for accurate IC50 calculations</title>
		<link>http://q-pharm.com/2009/06/free-energy-perturbation-theory-for-accurate-ic50-calculations/</link>
		<comments>http://q-pharm.com/2009/06/free-energy-perturbation-theory-for-accurate-ic50-calculations/#comments</comments>
		<pubDate>Sat, 27 Jun 2009 08:28:08 +0000</pubDate>
		<dc:creator>Peter Fedichev, Quantum CTO</dc:creator>
				<category><![CDATA[IC50]]></category>
		<category><![CDATA[Quantum Software]]></category>
		<category><![CDATA[solvation energy]]></category>
		<category><![CDATA[video]]></category>

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Free Energy perturbation molecular dynamics demonstration. The calculation lets the molecule escape from the binding site and give the free energy difference, directly related to the binding affinity


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		<title>New Quantum Water Model helps find stable ss DNA conformation in solution</title>
		<link>http://q-pharm.com/2009/03/new-quantum-water-model-helps-find-stable-ss-dna-conformation-in-solution/</link>
		<comments>http://q-pharm.com/2009/03/new-quantum-water-model-helps-find-stable-ss-dna-conformation-in-solution/#comments</comments>
		<pubDate>Wed, 11 Mar 2009 09:24:00 +0000</pubDate>
		<dc:creator>fedichev</dc:creator>
				<category><![CDATA[Quantum Software]]></category>
		<category><![CDATA[ss DNA]]></category>
		<category><![CDATA[video]]></category>
		<category><![CDATA[water]]></category>

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		<description><![CDATA[



ss DNA Molecular dynamics trajectory using the latest Quantum force field helps to find a perfectly stable conformation of the biomolecule in solution. The outcome of the simulation is very [...]


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		<slash:comments>0</slash:comments>
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		<title>Computer aided drug design video from Quantum Pharma</title>
		<link>http://q-pharm.com/2008/05/computer-aided-drug-design-video-from-quantum-pharma/</link>
		<comments>http://q-pharm.com/2008/05/computer-aided-drug-design-video-from-quantum-pharma/#comments</comments>
		<pubDate>Wed, 21 May 2008 11:37:00 +0000</pubDate>
		<dc:creator>fedichev</dc:creator>
				<category><![CDATA[docking]]></category>
		<category><![CDATA[IC50]]></category>
		<category><![CDATA[Quantum Software]]></category>
		<category><![CDATA[video]]></category>

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Molecular modelling software of Quantum Pharmaceuticals  is used to dock small molecule to active site of target protein. The molecular docking on flexible protein is explored. The Quantum docking [...]


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