Publication

Advances in density-functional-based modeling techniques - Recent extensions of the Car-Parrinello approach

2003
Book chapter

Abstract

A review discusses the basic concepts of the Car-Parrinello method, some of the recent methodol. extensions, focusing on aspects with potential interest for applications in medicinal chem., and the advantages and limitations of new modeling tools.

Official source

https://infoscience.epfl.ch/record/80941?ln=en

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Advances in density-functional-based modeling techniques - Recent extensions of the Car-Parrinello approach

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