Goerigk, Lars <br/><br/>
Accurate quantum chemical energies for tetrapeptide conformations: why MP2 data with an insufficient basis set should be handled with caution.  [electronic resource] 

 -  Physical chemistry chemical physics : PCCP  May 2013 
 - 7028-31 p.  digital 
<br/><br/> Publication Type: Journal Article; Research Support, Non-U.S. Gov't 
<br/><br/><label>ISSN: </label>1463-9084 
<br/><br/><label>Standard No.: </label>10.1039/c3cp00057e  doi 
<br/><br/><label>Subjects--Topical Terms: </label><br/>Hydrogen Bonding<br/>Models, Molecular<br/>Molecular Dynamics Simulation<br/>Oligopeptides--chemistry<br/>Protein Conformation<br/>Quantum Theory