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Metadynamics (MTD; also abbreviated as METAD or MetaD) is a computer simulation method in computational physics, chemistry and biology. It is used to… Expand
Wikipedia

## Papers overview

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Review
2020
Review
2020
• 2020
• Corpus ID: 215910346
Metadynamics is an atomistic simulation technique that allows, within the same framework, acceleration of rare events and… Expand
Review
2017
Review
2017
• 2017
• Corpus ID: 53383385
Peptoids, or poly-N-substituted glycines, are synthetic polymers composed of a protein backbone with side chains attached to the… Expand
2016
2016
• 2016
• Corpus ID: 33937973
The recent discovery of frustrated Lewis pairs (FLPs) capable of heterolytically splitting hydrogen gas at the surface of… Expand
2015
2015
• 2015
• Corpus ID: 118560513
A bstractAs one approaches the continuum limit, QCD systems, investigated via numerical simulations, remain trapped in sectors of… Expand
Review
2014
Review
2014
• Entropy
• 2014
• Corpus ID: 3014158
We review a selection of methods for performing enhanced sampling in 1 molecular dynamics simulations. We consider methods based… Expand
Highly Cited
2012
Highly Cited
2012
• 2012
• Corpus ID: 62722653
Metadynamics is an algorithm for accelerating rare events and reconstructing the associated free energy surface. It works by… Expand
2012
2012
• 2012
• Corpus ID: 12466937
National Science Foundation (U.S.). Division of Civil and Mechanical Systems (Grant 0856325)
Highly Cited
2010
Highly Cited
2010
• 2010
• Corpus ID: 118379598
The solid-liquid interface free energy ${\ensuremath{\gamma}}_{sl}$ is a key parameter controlling nucleation and growth during… Expand
Highly Cited
2009
Highly Cited
2009
Here we present a program aimed at free-energy calculations in molecular systems. It consists of a series of routines that can be… Expand
Review
2009
Review
2009
• 2009
• Corpus ID: 53384270
Computer simulations of molecular processes such as nucleation in first-order phase transitions or the folding of a protein are… Expand