M J Harvey
Publications by Year
Research Areas
Protein Structure and Dynamics, Scientific Computing and Data Management, Advanced Chemical Physics Studies, Computational Drug Discovery Methods, Cold Atom Physics and Bose-Einstein Condensates
Most-Cited Works
- → ACEMD: Accelerating Biomolecular Dynamics in the Microsecond Time Scale(2009)944 cited
- → HTMD: High-Throughput Molecular Dynamics for Molecular Discovery(2016)476 cited
- → An Implementation of the Smooth Particle Mesh Ewald Method on GPU Hardware(2009)402 cited
- → High-Throughput All-Atom Molecular Dynamics Simulations Using Distributed Computing(2010)201 cited
- → The Houk–List transition states for organocatalytic mechanisms revisited(2014)184 cited
- → The selective retardation of NADP+-dependent dehydrogenases by immobilized procion red HE-3B(1978)106 cited
- → A Convolutional Neural Network for Automated Detection of Humpback Whale Song in a Diverse, Long-Term Passive Acoustic Dataset(2021)106 cited
- → A Scalable Molecular Force Field Parameterization Method Based on Density Functional Theory and Quantum-Level Machine Learning(2019)90 cited
- → High-throughput molecular dynamics: the powerful new tool for drug discovery(2012)89 cited
- → Interlayer Structure and Bonding in Nonswelling Primary Amine Intercalated Clays(2005)75 cited