agiliopadua

Molecular simulation of ionic liquids

ENS de LyonLyon, France

Pinned Repositories

clandpol
Polarisable force field for ionic liquids
Language:Python81
compute_fep
Free energy perturbation in LAMMPS.
Language:C++21 6 08
coul-tt
Charge-dipole scaling
Language:C++0 2 01
desff
CL&P and CL&Pol force fields for DES
01
homebrew-extras
Some Homebrew formulae.
Language:Ruby11 3 56
lammps
Public development project of the LAMMPS MD software package
Language:C++42
lammps-conp
Constant potential method in LAMMPS
Language:C++1 3 01
lammps-drude
Drude pair polarizability in LAMMPS
Language:C++2 3 00
md
Course on molecular dynamics, 1st yr masters in Physical Sciences (Sciences de la Matière)
Language:Python30

agiliopadua's Repositories

agiliopadua/compute_fep
Free energy perturbation in LAMMPS.
Language:C++21 6 08
agiliopadua/homebrew-extras
Some Homebrew formulae.
Language:Ruby11 3 56
agiliopadua/clandpol
Polarisable force field for ionic liquids
Language:Python81
agiliopadua/lammps
Public development project of the LAMMPS MD software package
Language:C++42
agiliopadua/md
Course on molecular dynamics, 1st yr masters in Physical Sciences (Sciences de la Matière)
Language:Python30
agiliopadua/lammps-drude
Drude pair polarizability in LAMMPS
Language:C++2 3 00
agiliopadua/lammps-conp
Constant potential method in LAMMPS
Language:C++1 3 01
agiliopadua/coul-tt
Charge-dipole scaling
Language:C++0 2 01
agiliopadua/desff
CL&P and CL&Pol force fields for DES
01
agiliopadua/kaobook
A LaTeX class for books, reports or theses based on https://github.com/kenohori/thesis and https://github.com/Tufte-LaTeX/tufte-latex.
Language:TeX0 1 00
agiliopadua/lammps-USER-CONP2
updated constant potential plugin for LAMMPS
agiliopadua/ms-tools
High-throughput molecular simulation toolkit