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Journal of Computer-Aided Molecular Design|April 1, 1993
QSAR and conformational analysis of the antiinflammatory agent amfenac and analoguesJ Ruiz, M López, J Milà, et al.
Journal of Computer-Aided Molecular Design|August 1, 1996
Wavelets and molecular structureM Carson
Journal of Computer-Aided Molecular Design|November 6, 2010
Challenges in the determination of the binding modes of non-standard ligands in X-ray crystal complexesAlpeshkumar K Malde, Alan E Mark
Journal of Computer-Aided Molecular Design|November 16, 2010
Toward better QSAR/QSPR modeling: simultaneous outlier detection and variable selection using distribution of model featuresDongsheng Cao, Yizeng Liang, Qingsong Xu, et al.
Journal of Computer-Aided Molecular Design|December 1, 1990
A practical procedure for the determination of electrostatic charges of large moleculesM Orozco, F J Luque
Journal of Computer-Aided Molecular Design|February 24, 2011
Structure-guided fragment-based in silico drug design of dengue protease inhibitorsTim Knehans, Andreas Schüller, Danny N Doan, et al.
Journal of Computer-Aided Molecular Design|December 18, 2010
Quantitative structure-activity relationship analysis of β-amyloid aggregation inhibitorsShiri Stempler, Michal Levy-Sakin, Anat Frydman-Marom, et al.
Journal of Computer-Aided Molecular Design|December 25, 2010
DFT calculation of four new potential agents muscarinic of bispyridinium type: structure, synthesis, biological activity, hydration, and relations with the potents W84 and DUO-3OM Alcolea Palafox, P Posada-Moreno, A L Villarino-Marín, et al.
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