Showing results (671-680 of 1,314) with videos related to
Sort By:
Pageof 132
Journal of Chemical Information and Computer Sciences|November 24, 2004
Binding of fatty acids to beta-cryptogein: quantitative structure-activity relationships and design of selective protein mutantsPetr Dobes, Jan Kmunícek, Vladimír Mikes, et al.Journal of Chemical Information and Computer Sciences|November 24, 2004
The reduced graph descriptor in virtual screening and data-driven clustering of high-throughput screening dataG Harper, G S Bravi, S D Pickett, et al.Journal of Chemical Information and Computer Sciences|November 24, 2004
Design and characterization of libraries of molecular fragments for use in NMR screening against protein targetsNicolas Baurin, Fareed Aboul-Ela, Xavier Barril, et al.Journal of Chemical Information and Computer Sciences|May 25, 2004
Structure Elucidator: a versatile expert system for molecular structure elucidation from 1D and 2D NMR data and molecular fragmentsMikhail E Elyashberg, Kirill A Blinov, Antony J Williams, et al.Journal of Chemical Information and Computer Sciences|May 25, 2004
Chirality codes and molecular structureJoão Aires-de-Sousa, Johann Gasteiger, Ivan Gutman, et al.Journal of Chemical Information and Computer Sciences|May 25, 2004
Novel scoring functions comprising QXP, SASA, and protein side-chain entropy termsFabrizio Giordanetto, Simona Cotesta, Cornel Catana, et al.Journal of Chemical Information and Computer Sciences|May 25, 2004
The impact of available experimental data on the prediction of 1H NMR chemical shifts by neural networksYuri Binev, Marta Corvo, João Aires-de-SousaJournal of Chemical Information and Computer Sciences|May 25, 2004
On the aggregation state and QSPR models. The solubility of herbicides as a case studyEduardo J Delgado, Joel B Alderete, Adelio R Matamala, et al.Journal of Chemical Information and Computer Sciences|May 25, 2004
Classification of dopamine antagonists using TFS-based artificial neural networkSatoshi Fujishima, Yoshimasa TakahashiJournal of Chemical Information and Computer Sciences|May 25, 2004
Automated drawing of structural molecular formulas under constraintsPatrick C Fricker, Marcus Gastreich, Matthias RareyPageof 132