Internet resources integrating many small-molecule databases.

Avogadro: an advanced semantic chemical editor, visualization, and analysis platform. J Cheminform (2012) 4.10

Optical structure recognition software to recover chemical information: OSRA, an open source solution. J Chem Inf Model (2009) 1.81

Comparing the Chemical Structure and Protein Content of ChEMBL, DrugBank, Human Metabolome Database and the Therapeutic Target Database. Mol Inform (2013) 1.29

UniChem: extension of InChI-based compound mapping to salt, connectivity and stereochemistry layers. J Cheminform (2014) 1.04

Authentic HIV-1 integrase inhibitors. Future Med Chem (2010) 1.04

Consistency of systematic chemical identifiers within and between small-molecule databases. J Cheminform (2012) 0.99

Tautomerism in large databases. J Comput Aided Mol Des (2010) 0.97

MetNet Online: a novel integrated resource for plant systems biology. BMC Bioinformatics (2012) 0.86

Tautomerism and magnesium chelation of HIV-1 integrase inhibitors: a theoretical study. ChemMedChem (2010) 0.78

Computer tools in the discovery of HIV-1 integrase inhibitors. Future Med Chem (2010) 0.77

Ambiguity of non-systematic chemical identifiers within and between small-molecule databases. J Cheminform (2015) 0.77

Internet Databases of the Properties, Enzymatic Reactions, and Metabolism of Small Molecules-Search Options and Applications in Food Science. Int J Mol Sci (2016) 0.75

Experimental and Chemoinformatics Study of Tautomerism in a Database of Commercially Available Screening Samples. J Chem Inf Model (2016) 0.75

Many InChIs and quite some feat. J Comput Aided Mol Des (2015) 0.75

Comparison of the NCI open database with seven large chemical structural databases. J Chem Inf Comput Sci (2001) 2.03

Inhibition of (cytosine C5)-methyltransferase by oligonucleotides containing flexible (cyclopentane) and conformationally constrained (bicyclo[3.1.0]hexane) abasic sites. Nucleosides Nucleotides Nucleic Acids (2001) 1.05

National Cancer Institute Drug Information System 3D database. J Chem Inf Comput Sci (1994) 1.00

Conformationally locked nucleoside analogues. Synthesis of dideoxycarbocyclic nucleoside analogues structurally related to neplanocin C. J Med Chem (1994) 0.97

Adenosine deaminase prefers a distinct sugar ring conformation for binding and catalysis: kinetic and structural studies. Biochemistry (2000) 0.96

Discovery of novel, non-peptide HIV-1 protease inhibitors by pharmacophore searching. J Med Chem (1996) 0.95

Discovery of HIV-1 integrase inhibitors by pharmacophore searching. J Med Chem (1997) 0.90

Mutation of a conserved serine residue in a quinolone-resistant type II topoisomerase alters the enzyme-DNA and drug interactions. J Biol Chem (1999) 0.84

Interactions of conformationally biased north and south 2'-fluoro-2', 3'-dideoxynucleoside 5'-triphosphates with the active site of HIV-1 reverse transcriptase. Biochemistry (2000) 0.84

Depsides and depsidones as inhibitors of HIV-1 integrase: discovery of novel inhibitors through 3D database searching. J Med Chem (1997) 0.83

Conformationally restricted nucleosides. The reaction of adenosine deaminase with substrates built on a bicyclo[3.1.0]hexane template. Nucleosides Nucleotides (1999) 0.82

Conformationally constrained analogues of diacylglycerol. 18. The incorporation of a hydroxamate moiety into diacylglycerol-lactones reduces lipophilicity and helps discriminate between sn-1 and sn-2 binding modes to protein kinase C (PK-C). Implications for isozyme specificity. J Med Chem (2001) 0.80

An optimized protein kinase C activating diacylglycerol combining high binding affinity (Ki) with reduced lipophilicity (log P). J Med Chem (2001) 0.80

Identification of HIV-1 integrase inhibitors via three-dimensional database searching using ASV and HIV-1 integrases as targets. Bioorg Med Chem (2000) 0.79

Pharmacophores in drug design and discovery. SAR QSAR Environ Res (1998) 0.75

Molecular modeling in the discovery of drug leads. J Chem Inf Comput Sci (1996) 0.75

Use of computer graphics in drug design. NIDA Res Monogr (1993) 0.75

[The Spatial Variability of Methane Emission from Grass-Moss Fens of the Subtaiga and Forest-Steppe of Western Siberia]. Izv Akad Nauk Ser Biol (2016) 0.75

Protein kinase C. Modeling of the binding site and prediction of binding constants. J Med Chem (1994) 0.75

Computer-aided design and discovery of protein-protein interaction inhibitors as agents for anti-HIV therapy. SAR QSAR Environ Res (2014) 0.75