James G. Nourse

Reoptimization of MDL Keys for Use in Drug Discovery

Joseph L. Durant, Burton A. Leland, Douglas R. Henry et al. · Journal of Chemical Information and Computer Sciences · 2002 · 1.9K citations

Pharmacy, Medicinal Chemistry, Computational Chemistry +16

Description of several chemical structure file formats used by computer programs developed at Molecular Design Limited

A. E. Dalby, James G. Nourse, W. Douglas Hounshell et al. · Journal of Chemical Information and Computer Sciences · 1992 · 647 citations

Natural Sciences, Chemistry, Computational Chemistry +5

Applications of artificial intelligence for chemical inference. 37. GENOA: a computer program for structure elucidation utilizing overlapping and alternative substructures

Raymond E. Carhart, Dennis H. Smith, N. A. B. Gray et al. · The Journal of Organic Chemistry · 1981 · 89 citations

Natural Sciences, Chemistry, Computational Chemistry +13

Nuclear magnetic resonance spectroscopy. Carbon-13 spectra of some macrolide antibiotics and derivatives. Substituent and conformational effects

James G. Nourse, John D. Roberts · Journal of the American Chemical Society · 1975 · 56 citations

Pharmacy, Chemistry, Medicinal Chemistry +9

The dendral project: recent advances in computer- assisted structure elucidation

Dennis H. Smith, N. A. B. Gray, James G. Nourse et al. · Analytica Chimica Acta · 1981 · 54 citations

Life Sciences, Materials Science, Structural Analysis +9