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Acta Crystallographica. Section B, Structural Science|March 16, 2004
Model for the crystal packing and conformational changes of biphenyl in incommensurate phase transitionsAlexander Dzyabchenko, Harold A ScheragaJournal of Computational Chemistry|February 7, 2007
Influence of temperature, friction, and random forces on folding of the B-domain of staphylococcal protein A: all-atom molecular dynamics in implicit solventAnna Jagielska, Harold A ScheragaProceedings of the National Academy of Sciences of the United States of America|January 9, 2003
Insufficiently dehydrated hydrogen bonds as determinants of protein interactionsAriel Fernández, Harold A ScheragaAccounts of Chemical Research|July 4, 2009
Assessing the accuracy of protein structures by quantum mechanical computations of 13C(alpha) chemical shiftsJorge A Vila, Harold A ScheragaBiopolymers|February 26, 2003
Ab initio structure prediction of two alpha-helical oligomers with a multiple-chain united-residue force field and global searchJeffrey A Saunders, Harold A ScheragaJournal of Molecular Structure|September 19, 2017
Limiting Values of the one-bond C-H Spin-Spin Coupling Constants of the Imidazole Ring of Histidine at High-pHJorge A Vila, Harold A ScheragaBiochemistry|March 25, 2009
Oxidative folding pathway of onconase, a ribonuclease homologue: insight into oxidative folding mechanisms from a study of two homologuesRobert F Gahl, Harold A ScheragaBiopolymers|February 26, 2003
Challenges in structure prediction of oligomeric proteins at the united-residue level: searching the multiple-chain energy landscape with CSA and CFMCJeffrey A Saunders, Harold A ScheragaThe Journal of Physical Chemistry. B|April 11, 2008
An efficient method for calculating atomic charges of peptides and proteins from electronic populationsYoung Kee Kang, Harold A ScheragaJournal of Computational Chemistry|May 27, 2022
Exact analytical loop closure in proteins using polynomial equationsWilliam J Wedemeyer, Harold A ScheragaPageof 26