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Designing Novel Polymers with Targeted Properties Using the Signature Molecular Descriptor.

, , , and . Journal of Chemical Information and Modeling, 46 (2): 826-835 (2006)

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Genome scale enzyme-metabolite and drug-target interaction predictions using the signature molecular descriptor., , , , and . Bioinform., 24 (2): 225-233 (2008)SensiPath: computer-aided design of sensing-enabling metabolic pathways., , , and . Nucleic Acids Res., 44 (Webserver-Issue): W226-W231 (2016)Cheminformatics., , , , , , , , , and . Commun. ACM, 55 (11): 65-75 (2012)PMG: Multi-core Metabolite Identification., , , , , , and . CS2Bio, volume 299 of Electronic Notes in Theoretical Computer Science, page 53-60. Elsevier, (2013)The Signature Molecular Descriptor. 1. Using Extended Valence Sequences in QSAR and QSPR Studies., , and . Journal of Chemical Information and Computer Sciences, 43 (3): 707-720 (2003)Stereo Signature Molecular Descriptor., , and . Journal of Chemical Information and Modeling, 53 (4): 887-897 (2013)Expanding Biosensing Abilities through Computer-Aided Design of Metabolic Pathways, , and . ACS Synth. Biol., (Mar 30, 2016)Stochastic Generator of Chemical Structure, 2. Using Simulated Annealing To Search the Space of Constitutional Isomers.. Journal of Chemical Information and Computer Sciences, 36 (4): 731-740 (1996)Isomorphism, Automorphism Partitioning, and Canonical Labeling Can Be Solved in Polynomial-Time for Molecular Graphs.. Journal of Chemical Information and Computer Sciences, 38 (3): 432-444 (1998)Predicting protein-protein interactions using signature products., , and . Bioinform., 21 (2): 218-226 (2005)