Q30378316 | A cellular chemical probe targeting the chromodomains of Polycomb repressive complex 1 |
Q42380933 | A fast, open source implementation of adaptive biasing potentials uncovers a ligand design strategy for the chromatin regulator BRD4. |
Q39721704 | Evaluating the dynamics and electrostatic interactions of folded proteins in implicit solvents |
Q53064363 | Improved scaling of temperature-accelerated dynamics using localization |
Q86365758 | Localized saddle-point search and application to temperature-accelerated dynamics |
Q36948989 | Multivalent histone engagement by the linked tandem Tudor and PHD domains of UHRF1 is required for the epigenetic inheritance of DNA methylation |
Q47615289 | Optimal updating magnitude in adaptive flat-distribution sampling. |
Q57289952 | Protein Conformational Transitions from All-Atom Adaptively Biased Path Optimization |
Q51825475 | Sculpting bespoke mountains: Determining free energies with basis expansions. |
Q41455059 | Unrestrained computation of free energy along a path |
Q35887074 | Using sketch-map coordinates to analyze and bias molecular dynamics simulations |
Q51069984 | Well-tempered metadynamics converges asymptotically |
Q53239658 | μ-tempered metadynamics: Artifact independent convergence times for wide hills |
Search more.