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	1.	Limits of Free Energy Computation for Protein-Ligand Interactions. [electronic resource] by Merz, Kenneth M Publication details: Journal of chemical theory and computation 2010 In: Journal of chemical theory and computation vol. 6 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	2.	Introducing the Review Manuscript Type. [electronic resource] by Merz, Kenneth M Producer: 20160525 In: Journal of chemical information and modeling vol. 55 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	3.	Investing in the Future. [electronic resource] by Merz, Kenneth M Producer: 20190624 In: Journal of chemical information and modeling vol. 58 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	4.	Using quantum mechanical approaches to study biological systems. [electronic resource] by Merz, Kenneth M Producer: 20150623 In: Accounts of chemical research vol. 47 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	5.	Molecular dynamics and quantum chemical studies on the catalytic mechanism of Delta5-3-ketosteroid isomerase: the catalytic diad versus the cooperative hydrogen bond mechanism. [electronic resource] by Park, Hwangseo Merz, Kenneth M Producer: 20030409 In: Journal of the American Chemical Society vol. 125 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	6.	The hydrolysis of urea and the proficiency of urease. [electronic resource] by Estiu, Guillermina Merz, Kenneth M Producer: 20040827 In: Journal of the American Chemical Society vol. 126 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	7.	Acceleration of High Angular Momentum Electron Repulsion Integrals and Integral Derivatives on Graphics Processing Units. [electronic resource] by Miao, Yipu Merz, Kenneth M Producer: 20160909 In: Journal of chemical theory and computation vol. 11 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	8.	MCPB.py: A Python Based Metal Center Parameter Builder. [electronic resource] by Li, Pengfei Merz, Kenneth M Producer: 20170731 In: Journal of chemical information and modeling vol. 56 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	9.	The Utility of the HSAB Principle via the Fukui Function in Biological Systems. [electronic resource] by Faver, John Merz, Kenneth M Publication details: Journal of chemical theory and computation Feb 2010 In: Journal of chemical theory and computation vol. 6 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	10.	Force field design and molecular dynamics simulations of the carbapenem- and cephamycin-resistant dinuclear zinc metallo-beta-lactamase from Bacteroides fragilis and its complex with a biphenyl tetrazole inhibitor. [electronic resource] by Park, Hwangseo Merz, Kenneth M Producer: 20050411 In: Journal of medicinal chemistry vol. 48 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	11.	A quantum mechanics-based scoring function: study of zinc ion-mediated ligand binding. [electronic resource] by Raha, Kaushik Merz, Kenneth M Producer: 20040525 In: Journal of the American Chemical Society vol. 126 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	12.	Computational studies of the farnesyltransferase ternary complex part II: the conformational activation of farnesyldiphosphate. [electronic resource] by Cui, Guanglei Merz, Kenneth M Producer: 20080110 In: Biochemistry vol. 46 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	13.	The intrinsic dynamics and function of nickel-binding regulatory protein: insights from elastic network analysis. [electronic resource] by Cui, Guanglei Merz, Kenneth M Producer: 20080521 In: Biophysical journal vol. 94 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	14.	Ligand Identification Scoring Algorithm (LISA). [electronic resource] by Zheng, Zheng Merz, Kenneth M Producer: 20111021 In: Journal of chemical information and modeling vol. 51 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	15.	Enzymatic catalysis of urea decomposition: elimination or hydrolysis? [electronic resource] by Estiu, Guillermina Merz, Kenneth M Producer: 20050502 In: Journal of the American Chemical Society vol. 126 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	16.	Divide-and-Conquer Hartree-Fock Calculations on Proteins. [electronic resource] by He, Xiao Merz, Kenneth M Publication details: Journal of chemical theory and computation Jan 2010 In: Journal of chemical theory and computation vol. 6 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	17.	Importance of loop dynamics in the neocarzinostatin chromophore binding and release mechanisms. [electronic resource] by Wang, Bing Merz, Kenneth M Producer: 20100719 In: Physical chemistry chemical physics : PCCP vol. 12 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	18.	Development of the knowledge-based and empirical combined scoring algorithm (KECSA) to score protein-ligand interactions. [electronic resource] by Zheng, Zheng Merz, Kenneth M Producer: 20131223 In: Journal of chemical information and modeling vol. 53 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	19.	Validation of the binding site structure of the cellular retinol-binding protein (CRBP) by ligand NMR chemical shift perturbations. [electronic resource] by Wang, Bing Merz, Kenneth M Producer: 20050620 In: Journal of the American Chemical Society vol. 127 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	20.	Catalyzed decomposition of urea. Molecular dynamics simulations of the binding of urea to urease. [electronic resource] by Estiu, Guillermina Merz, Kenneth M Producer: 20060530 In: Biochemistry vol. 45 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)

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Your search returned 196 results.