Vincent A. Voelz

According to our database, Vincent A. Voelz authored at least 11 papers between 2009 and 2023.

Collaborative distances:

• Dijkstra number of four.
• Erdős number of four.

2023

BICePs v2.0: Software for Ensemble Reweighting Using Bayesian Inference of Conformational Populations.

Robert M. Raddi, Yunhui Ge, Vincent A. Voelz

J. Chem. Inf. Model., April, 2023

2021

Metal Cation-Binding Mechanisms of Q-Proline Peptoid Macrocycles in Solution.

Matthew F. D. Hurley, Justin D. Northrup, Yunhui Ge, Christian E. Schafmeister, Vincent A. Voelz

J. Chem. Inf. Model., 2021

Solution-State Preorganization of Cyclic β-Hairpin Ligands Determines Binding Mechanism and Affinities for MDM2.

Yunhui Ge, Si Zhang, Mate Erdelyi, Vincent A. Voelz

J. Chem. Inf. Model., 2021

Stacking Gaussian processes to improve pK_a predictions in the SAMPL7 challenge.

Robert M. Raddi, Vincent A. Voelz

J. Comput. Aided Mol. Des., 2021

Assigning Confidence to Molecular Property Prediction.

AkshatKumar Nigam, Robert Pollice, Matthew F. D. Hurley, Riley J. Hickman, Matteo Aldeghi, Naruki Yoshikawa, Seyone Chithrananda, Vincent A. Voelz, Alán Aspuru-Guzik

CoRR, 2021

2017

Computational and Experimental Evaluation of Designed β-Cap Hairpins Using Molecular Simulations and Kinetic Network Models.

Yunhui Ge, Brandon L. Kier, Niels H. Andersen, Vincent A. Voelz

J. Chem. Inf. Model., July, 2017

2015

Molecular Simulation of Conformational Pre-Organization in Cyclic RGD Peptides.

Amanda E. Wakefield, William M. Wuest, Vincent A. Voelz

J. Chem. Inf. Model., 2015

2014

Computational Screening and Selection of Cyclic Peptide Hairpin Mimetics by Molecular Simulation and Kinetic Network Models.

Asghar M. Razavi, William M. Wuest, Vincent A. Voelz

J. Chem. Inf. Model., 2014

Bayesian inference of conformational state populations from computational models and sparse experimental observables.

Vincent A. Voelz, Guangfeng Zhou

J. Comput. Chem., 2014

2009

Predicting Peptide Structures in Native Proteins from Physical Simulations of Fragments.

Vincent A. Voelz, M. Scott Shell, Ken A. Dill

PLoS Comput. Biol., 2009

A Multiscale Approach to Sampling Nascent Peptide Chains in the Ribosomal Exit Tunnel.

Vincent A. Voelz, Paula Petrone, Vijay S. Pande

Proceedings of the Biocomputing 2009: Proceedings of the Pacific Symposium, 2009