PLUMED-ISDB

Here are listed the collective variables, functions and biases originally developed for the Integrative Structural and Dynamical Biology module of PLUMED. They are related but not limited to the interpretation and modelling of experimental data in molecular modelling.

• CVs Documentation
• Functions Documentation
• Biases Documentation

Furthermore using SELECTOR it is possible to define a variable inside the PLUMED code that can be used and modified by other actions. For example, a SELECTOR can be used in combination with RESCALE to activate a simulated-tempering like approach.

Additional tutorials focused on the ISDB module are included in the following and are meant as advanced tutorials.

• Tutorials