45 skills found · Page 2 of 2
velocirobbie / GraFFA Graphene and Graphite Forcefield for LAMMPS
WMD-group / VMOFA general forcefield for phonon properties of metal-organic frameworks
MarcusXie3D / ForceFieldShockWaveVFXForce Field VFX That Absorbs Shockwave
nlesc-nano / Auto FOXA library for analyzing potential energy surfaces (PESs) and using the resulting PES descriptors for constructing forcefield parameters.
openforcefield / Open Forcefield DataDatasets for open forcefield parameterization and development
kimjc95 / AddNewResidue.pyThis code adds custom-made amino acids to the GROMACS forcefield directory.
collidingScopes / ForcefieldTurn photos into forcefield particle animations in real-time. js + canvas, open source
openforcefield / Open Forcefield ToolsTools for open forcefield development
rsdefever / AntefoyerAntechamber plugin to foyer and support for the GAFF forcefield
WMD-group / BTW FFA forcefield to describe the structures and properties of metal-organic frameworks
Martini-Force-Field-Initiative / GoMartiniNew virtual-site implementation of GōMartini for the Martini 3 forcefield
trevorgokey / BesmartsA toolkit for data-driven force field design based on binary-encoded SMARTS
Roy-Kid / ADMPAutomatic Differentiation Multipole Moment Molecular Forcefield
ClementiGroup / Mlcg TkTools to prepare data for use in training a transferable coarse grained (CG) forcefield using the MLCG package
aurilisdev / Modular ForcefieldsModular Forcefields next Minecraft technological mod. It intends to bring back aspects from older mods, while also introducing new content. Modular Forcefields is meant to be realistic, but still an enjoyable mod.
anandojha / QmmmrebindQuantum Mechanics – Molecular Mechanics ( QMMM ) forcefield Reparamaterisation of the Binding site for the receptor-ligand complexes
4ndrecarvalho / SILVIAModeling the synthesis of SILica materials VIA multiscale computer simulation. (implementation in MARTINI forcefield)
MMunibas / FittingWizardWebA Java-based WebApp that assists the user for perfoming forcefield parameters optimisation by using Quantum Chemistry and Molecular Dynamics software
Acellera / FfevaluationForcefield evaluation in python using numba
MissingNO123 / VRC Drone ForceFieldsScript to create force fields that can affect players' drones
