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Magnetic Resonance in Chemistry : MRC|January 15, 2016
Di(ethylene glycol) methyl ether methacrylate (DEGMEMA)-derived gels align small organic molecules in methanolManuela E García, Shannon R Woodruff, Erich Hellemann, et al.Journal of Chemical Information and Modeling|June 6, 2013
Comparing neural-network scoring functions and the state of the art: applications to common library screeningJacob D Durrant, Aaron J Friedman, Kathleen E Rogers, et al.Plos Computational Biology|April 2, 2020
ProteinVR: Web-based molecular visualization in virtual realityKevin C Cassidy, Jan Šefčík, Yogindra Raghav, et al.Digital Discovery|February 27, 2026
Precision fragment addition: domain-specific DeepFrag2 models for smarter lead optimizationCésar R García-Jacas, Harrison Green, Shayne D Wierbowski, et al.Chemistry (Weinheim an Der Bergstrasse, Germany)|October 15, 2016
Mechanical Behavior of Polymer Gels for RDCs and RCSAs Collection: NMR Imaging Study of Buckling PhenomenaErich Hellemann, Rubens R Teles, Fernando Hallwass, et al.Magnetic Resonance in Chemistry : MRC|January 13, 2018
Measurement of residual chemical shift anisotropies in compressed polymethylmethacrylate gels. Automatic compensation of gel isotropic shift contributionFernando Hallwass, Rubens R Teles, Erich Hellemann, et al.Journal of Natural Products|January 26, 2017
Application of Residual Dipolar Couplings and Selective Quantitative NOE to Establish the Structures of Tetranortriterpenoids from Xylocarpus rumphiiWatcharee Waratchareeyakul, Erich Hellemann, Roberto R Gil, et al.Current Opinion in Structural Biology|March 27, 2014
Computational approaches to mapping allosteric pathwaysVictoria A Feher, Jacob D Durrant, Adam T Van Wart, et al.Journal of Medicinal Chemistry|June 10, 2010
Computer-aided identification of Trypanosoma brucei uridine diphosphate galactose 4'-epimerase inhibitors: toward the development of novel therapies for African sleeping sicknessJacob D Durrant, Michael D Urbaniak, Michael A J Ferguson, et al.Plos Neglected Tropical Diseases|September 3, 2010
Novel naphthalene-based inhibitors of Trypanosoma brucei RNA editing ligase 1Jacob D Durrant, Laurence Hall, Robert V Swift, et al.Pageof 9