This paper introducesPYCV, a module for the PLUMED 2 library which enables users todefine CVs and arbitrary functions in the Python language. CV implementations may thus bemodified and tested independently of the main code, with essentially no "test latency".
PYCV: a PLUMED 2 Module Enabling the Rapid Prototyping of Collective Variables in Python
Toni Giorgino
2019
Abstract
This paper introducesPYCV, a module for the PLUMED 2 library which enables users todefine CVs and arbitrary functions in the Python language. CV implementations may thus bemodified and tested independently of the main code, with essentially no "test latency".File in questo prodotto:
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