Published in J Mol Model on June 23, 2010
Exploration of type II binding mode: A privileged approach for kinase inhibitor focused drug discovery? ACS Chem Biol (2014) 1.23
Metabolite profiling and biological activities of bioactive compounds produced by Chrysosporium lobatum strain BK-3 isolated from Kaziranga National Park, Assam, India. Springerplus (2013) 0.76
CLUSTAL W: improving the sensitivity of progressive multiple sequence alignment through sequence weighting, position-specific gap penalties and weight matrix choice. Nucleic Acids Res (1994) 392.47
Development and validation of a genetic algorithm for flexible docking. J Mol Biol (1997) 14.36
A fast flexible docking method using an incremental construction algorithm. J Mol Biol (1996) 7.33
Comparative molecular field analysis (CoMFA). 1. Effect of shape on binding of steroids to carrier proteins. J Am Chem Soc (1988) 6.41
Diversity of group types, regulation, and function of phospholipase A2. J Biol Chem (1994) 4.35
Molecular similarity indices in a comparative analysis (CoMSIA) of drug molecules to correlate and predict their biological activity. J Med Chem (1994) 3.60
Amino acid sequence of phospholipase A2-alpha from the venom of Crotalus adamanteus. A new classification of phospholipases A2 based upon structural determinants. J Biol Chem (1977) 1.81
Increasing molecular diversity of secreted phospholipases A(2) and their receptors and binding proteins. Biochim Biophys Acta (2000) 1.76
Virtual screening in drug discovery -- a computational perspective. Curr Protein Pept Sci (2007) 1.32
Phospholipase A2 inhibitors as potential anti-inflammatory agents. Curr Pharm Des (2005) 1.18
Increased group II phospholipase A2 in colonic mucosa of patients with Crohn's disease and ulcerative colitis. Gut (1994) 1.11
Molecular lipophilicity potential, a tool in 3D QSAR: method and applications. J Comput Aided Mol Des (1994) 1.01
Crystal structure of the 1:2:2 adduct of piperazine, o-phthalic acid and water. Anal Sci (2003) 0.99
Indole inhibitors of human nonpancreatic secretory phospholipase A2. 3. Indole-3-glyoxamides. J Med Chem (1996) 0.97
In silico-guided target identification of a scaffold-focused library: 1,3,5-triazepan-2,6-diones as novel phospholipase A2 inhibitors. J Med Chem (2006) 0.92
Indole inhibitors of human nonpancreatic secretory phospholipase A2. 1. Indole-3-acetamides. J Med Chem (1996) 0.90
Characterization and activity of phospholipase A2 in normal human epidermis and in lesion-free epidermis of patients with psoriasis or eczema. Br J Dermatol (1985) 0.87
Indole inhibitors of human nonpancreatic secretory phospholipase A2. 2. Indole-3-acetamides with additional functionality. J Med Chem (1996) 0.85
Potential choline kinase inhibitors: a molecular modeling study of bis-quinolinium compounds. J Mol Graph Model (2008) 0.83
Molecular modeling studies of phenoxypyrimidinyl imidazoles as p38 kinase inhibitors using QSAR and docking. Eur J Med Chem (2007) 0.83
Molecular modeling studies of pyridopurinone derivatives--potential phosphodiesterase 5 inhibitors. J Mol Graph Model (2007) 0.83
Non-steroidal anti-inflammatory drugs as potent inhibitors of phospholipase A2: structure of the complex of phospholipase A2 with niflumic acid at 2.5 Angstroms resolution. Acta Crystallogr D Biol Crystallogr (2005) 0.81
Inhibition of secretory phospholipase A2. 2-Synthesis and structure-activity relationship studies of 4,5-dihydro-3-(4-tetradecyloxybenzyl)-1,2,4-4H-oxadiazol-5-one (PMS1062) derivatives specific for group II enzyme. Bioorg Med Chem (2005) 0.80
Secretory group II phospholipase A(2) : a newly recognized acute-phase reactant with a role in atherogenesis. Circ Res (2000) 0.76
A molecular modeling and 3D QSAR study of a large series of indole inhibitors of human non-pancreatic secretory phospholipase A2. Eur J Med Chem (2001) 0.76
Strategies to design pyrazolyl urea derivatives for p38 kinase inhibition: a molecular modeling study. J Comput Aided Mol Des (2007) 0.75
Structure-activity relationships in platelet-activating factor (PAF). 11-From PAF-antagonism to phospholipase A(2) inhibition: syntheses and structure-activity relationships in 1-arylsulfamido-2-alkylpiperazines. Eur J Med Chem (2001) 0.75
Vitamin D status and bone mineral density in women of reproductive and postmenopausal age groups: a cross-sectional study from south India. J Assoc Physicians India (2011) 1.64
Quinazolinone linked pyrrolo[2,1-c][1,4]benzodiazepine (PBD) conjugates: Design, synthesis and biological evaluation as potential anticancer agents. Bioorg Med Chem (2009) 1.33
Choline kinase: an important target for cancer. Curr Med Chem (2006) 1.16
Effect of alkyl substitution on H-bond strength of substituted amide-alcohol complexes. J Mol Model (2010) 0.86
Towards design of the smallest planar tetracoordinate carbon and boron systems. J Comput Chem (2007) 0.79
Contrasting preferences of N and P substituted heteroaromatics towards metal binding: probing the regioselectivity of Li+ and Mg2+ binding to (CH)(6-m-n)N(m)P(n). Phys Chem Chem Phys (2012) 0.78
A computational investigation and the conformational analysis of dimers, anions, cations, and zwitterions of L-phenylalanine. J Comput Chem (2011) 0.75