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Journal of Computer-Aided Molecular Design|January 2, 2004
Benzimidazole derivatives. 4. The recognition of the voluminous substituent attached to the basic amino group of 5-HT4 receptor antagonistsMaria L López-Rodríguez, Bellinda Benhamú, Marta Murcia, et al.Journal of Computer-Aided Molecular Design|January 10, 2004
New atom-type-based AI topological indices: application to QSPR studies of aldehydes and ketonesBiye RenJournal of Computer-Aided Molecular Design|November 26, 2003
Comparative binding energy analysis of haloalkane dehalogenase substrates: modelling of enzyme-substrate complexes by molecular docking and quantum mechanical calculationsJan Kmunícek, Michal Bohác, Santos Luengo, et al.Journal of Computer-Aided Molecular Design|November 26, 2003
CoMFA and docking study of novel estrogen receptor subtype selective ligandsPeter Wolohan, David E ReichertJournal of Computer-Aided Molecular Design|September 19, 2003
Ligand binding to domain-3 of human serum albumin: a chemometric analysisPhilip J Hajduk, Renaldo Mendoza, Andrew M Petros, et al.Journal of Computer-Aided Molecular Design|September 19, 2003
New developments in PEST shape/property hybrid descriptorsCurt M Breneman, C Matthew Sundling, N Sukumar, et al.Journal of Computer-Aided Molecular Design|October 26, 2007
A successful virtual screening application: prediction of anticonvulsant activity in MES test of widely used pharmaceutical and food preservatives methylparaben and propylparabenAlan Talevi, Carolina L Bellera, Eduardo A Castro, et al.Journal of Computer-Aided Molecular Design|August 1, 1991
Structural investigations and modeling of cavities in clathratesL Pang, E A Lucken, J Weber, et al.Journal of Computer-Aided Molecular Design|November 9, 2007
Rational design of an enzyme mutant for anti-cocaine therapeuticsFang Zheng, Chang-Guo ZhanJournal of Computer-Aided Molecular Design|November 17, 2007
Comparative study of the prereactive protein kinase A Michaelis complex with kemptide substrateManuel Montenegro, Mireia Garcia-Viloca, Angels González-Lafont, et al.Pageof 265