LAMMPS Patch Release 18 June 2019
Changes since patch release 5 June 2019: using PLUMED to compute committor with LAMMPS, PR #1516, Gareth Tribello, Queen’s U Belfast) correctly support hybrid pair styles with computes from the USER-TALLY…
A Summary of DeepMind’s Protein Folding Upset at CASP13
At last year’s Critical Assessment of protein Structure Prediction competition (CASP13), researchers from DeepMind made headlines by taking the top position in the free modeling category by a considerable margin,…
LAMMPS Patch Release 31 May 2019
New LAMMPS Patch Release Update Changes since patch release 15 May 2019: More meaningful error messages when a style is not found. Now LAMMPS will report, which package an unrecognized…
LAMMPS Patch Release 29 March 2019
New LAMMPS Patch Release Update Changes since patch release 28 February 2019: new generalized granular pair style granular, that allows much more flexible parameter settings: #1342 (Dan S. Bolintineanu, Ishan…
LAMMPS Patch Release 28 February 2019
LAMMPS is a highly flexible, highly scalable software suite for molecular dynamics developed by Sandia National Laboratories. Listed below is their newest patch release, as of February 28, 2019. New…