Happy to announce our latest article, a tutorial on running Gaussian-accelerated MD simulations in NAMD. Tour de force work by @hmmichel.bsky.social with @mdpoleto.bsky.social that unifies theory and practice in one place! livecomsjournal.org/index.php/li...
Running Gaussian-accelerated Molecular Dynamics Simulations in NAMD [Article v1.0] | Living Journal of Computational Molecular Science
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