activity
20042008
most citedReplica exchange molecular dynamics simulations of amyloid peptide aggregation

225 citations · 647 across the 6 of their papers we have counts for

collaborators

6 papers

cs.DS2008★ 58 cited

Multistep greedy algorithm identifies community structure in real-world and computer-generated networks

Philipp Schuetz, Amedeo Caflisch

We have recently introduced a multistep extension of the greedy algorithm for modularity optimization. The extension is based on the idea that merging l pairs of communities (l>1)…

cs.DS2007★ 165 cited

Efficient modularity optimization by multistep greedy algorithm and vertex mover refinement

Philipp Schuetz, Amedeo Caflisch

Identifying strongly connected substructures in large networks provides insight into their coarse-grained organization. Several approaches based on the optimization of a quality fu…

q-bio.BM2005★ 35 cited

Estimation of protein folding probability from equilibrium simulations

Francesco Rao, Giovanni Settanni, Enrico Guarnera +1

The assumption that similar structures have similar folding probabilities () leads naturally to a procedure to evaluate for every snapshot saved along an equil…

cond-mat.dis-nn2005★ 164 cited

Local modularity measure for network clusterizations

Stefanie Muff, Francesco Rao, Amedeo Caflisch

Many complex networks have an underlying modular structure, i.e., structural subunits (communities or clusters) characterized by highly interconnected nodes. The modularity has…

q-bio.BM2004★ 225 cited

Replica exchange molecular dynamics simulations of amyloid peptide aggregation

M. Cecchini, F. Rao, M. Seeber +1

The replica exchange molecular dynamics (REMD) approach is applied to four oligomeric peptide systems. At physiologically relevant temperature values REMD samples conformation spac…

q-bio.BM2004

The protein folding network

Francesco Rao, Amedeo Caflisch

The conformation space of a 20-residue antiparallel -sheet peptide, sampled by molecular dynamics simulations, is mapped to a network. Conformations are nodes of the network, an…