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Journal Abstract Search
320 related items for PubMed ID: 15288243
1. Integrating virtual screening in lead discovery. Oprea TI, Matter H. Curr Opin Chem Biol; 2004 Aug; 8(4):349-58. PubMed ID: 15288243 [Abstract] [Full Text] [Related]
7. Ligand-based virtual screening and in silico design of new antimalarial compounds using nonstochastic and stochastic total and atom-type quadratic maps. Marrero-Ponce Y, Iyarreta-Veitía M, Montero-Torres A, Romero-Zaldivar C, Brandt CA, Avila PE, Kirchgatter K, Machado Y. J Chem Inf Model; 2005 Mar; 45(4):1082-100. PubMed ID: 16045304 [Abstract] [Full Text] [Related]
8. Importance of molecular computer modeling in anticancer drug development. Geromichalos GD. J BUON; 2007 Sep; 12 Suppl 1():S101-18. PubMed ID: 17935268 [Abstract] [Full Text] [Related]
9. The use of protein-ligand interaction fingerprints in docking. Brewerton SC. Curr Opin Drug Discov Devel; 2008 May; 11(3):356-64. PubMed ID: 18428089 [Abstract] [Full Text] [Related]
11. The effect of ligand-based tautomer and protomer prediction on structure-based virtual screening. Kalliokoski T, Salo HS, Lahtela-Kakkonen M, Poso A. J Chem Inf Model; 2009 Dec; 49(12):2742-8. PubMed ID: 19928753 [Abstract] [Full Text] [Related]
13. Improved lead-finding for kinase targets using high-throughput docking. McInnes C. Curr Opin Drug Discov Devel; 2006 May; 9(3):339-47. PubMed ID: 16729730 [Abstract] [Full Text] [Related]
14. Computer-aided design of chiral ligands. Part III. A novel ligand for asymmetric allylation designed using computational techniques. Kozlowski MC, Waters SP, Skudlarek JW, Evans CA. Org Lett; 2002 Dec 12; 4(25):4391-3. PubMed ID: 12465895 [Abstract] [Full Text] [Related]
16. Structure-based drug metabolism predictions for drug design. Sun H, Scott DO. Chem Biol Drug Des; 2010 Jan 12; 75(1):3-17. PubMed ID: 19878193 [Abstract] [Full Text] [Related]
18. Structure-based approaches to drug design and virtual screening. Waszkowycz B. Curr Opin Drug Discov Devel; 2002 May 12; 5(3):407-13. PubMed ID: 12058616 [Abstract] [Full Text] [Related]