Harold A. Scheraga
Cornell University
1160 Papers
25.6K Citations
Harold A. Scheraga is an academic researcher from Cornell University. The author has contributed to research in topics: Protein structure & Protein folding. The author has an hindex of 120, co-authored 1152 publications. Previous affiliations of Harold A. Scheraga include University of Gdańsk & National University of San Luis.
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Papers
High-resolution NMR studies of fibrinogen-like peptides in solution: structural basis for the bleeding disorder caused by a single mutation of Gly(12) to Val(12) in the A alpha chain of human fibrinogen Rouen.
TL;DR: Binding of thrombin to peptides F16 and F17, and hence to tF16 and tF17 as a result of the cleavage of the Arg( 16)-Gly(17) peptide bond, broadens the proton resonances of residues Asp(7) to Arg(16), suggesting that throm bin interacts specifically with this sequence of residues.
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New developments of the electrostatically driven monte carlo method: Test on the membrane‐bound portion of melittin
TL;DR: The electrostatically driven Monte Carlo (EDMC) method has been greatly improved by adding a series of new features, including a procedure for cluster analysis of the accepted conformations, which suggest that this conformation corresponds to the global energy minimum of the ECEPP/3 potential function for this specific sequence.
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Regeneration of bovine pancreatic ribonuclease A. 4. Temperature dependence of the regeneration rate.
TL;DR: There is a significant change in the distribution of three- Disulfide intermediates populated during regeneration with DTTox/DTTred over the range of temperature 15-37 degrees C that suggests that the three-disulfide species populated at 15 degrees C are directly involved in the major regeneration pathway observed at 25 degrees C.
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Macromolecular conformational dynamics in torsional angle space
Siqian He,Harold A. Scheraga +1 more
TL;DR: In this paper, a Brownian dynamics treatment in torsional angle space is presented for the simulation of conformational dynamics of macromolecules with fixed bond lengths and bond angles and with an arbitrary intramolecular potential energy function.
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