J. Andrew McCammon

Available identifiers

zbMath Open mccammon.j-andrewMaRDI QIDQ340103

List of research outcomes

Publication	Date of Publication	Type
The implementation of the colored abstract simplicial complex and its application to mesh generation	2020-04-24	Paper
Variational implicit-solvent predictions of the dry–wet transition pathways for ligand–receptor binding and unbinding kinetics	2020-03-04	Paper
Hierarchical orthogonal matrix generation and matrix-vector multiplications in rigid body simulations	2018-05-18	Paper
Mathematical and numerical aspects of the adaptive fast multipole Poisson-Boltzmann solver	2017-10-27	Paper
Potential drug-like inhibitors of group 1 influenza neuraminidase identified through computer-aided drug design	2017-07-10	Paper
AFMPB: an adaptive fast multipole Poisson-Boltzmann solver for calculating electrostatics in biomolecular systems	2016-11-11	Paper
Multi-core CPU or GPU-accelerated multiscale modeling for biomolecular complexes	2013-12-05	Paper
Browndye: A software package for Brownian dynamics	2011-06-30	Paper
AFMPB: an adaptive fast multipole Poisson-Boltzmann solver for calculating electrostatics in biomolecular systems	2011-05-31	Paper
https://portal.mardi4nfdi.de/entity/Q5457148	2008-04-14	Paper
``New-version-fast-multipole-method accelerated electrostatic calculations in biomolecular sys\-tems	2007-11-01	Paper
ISIM: A Program for Grand Canonical Monte Carlo Simulations of the Ionic Environment of Biomolecules	2004-03-18	Paper
https://portal.mardi4nfdi.de/entity/Q2712865	2001-08-05	Paper
https://portal.mardi4nfdi.de/entity/Q2712844	2001-07-19	Paper
NWChem: Exploiting parallelism in molecular simulations	2001-01-30	Paper
OOMPAA -- Object-oriented model for probing assemblages of atoms	1999-09-22	Paper
ICIAM/GAMM 95 Applied sciences, especially Mechanics Minisymposia Contributions	1997-11-12	Paper
Ordinary differential equations of molecular dynamics	1995-02-09	Paper
https://portal.mardi4nfdi.de/entity/Q3139354	1994-06-14	Paper

Research outcomes over time

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