Cover Image

openforcefield/openff-nagl-models

Fuente: Zenodo

Saved in:

Bibliographic Details
Main Authors:	Wang, Lily, Horton, Joshua, Boothroyd, Simon, Alibay, Irfan, Thompson, Matthew W.
Format:	Recurso digital
Published:	Zenodo 2025
Subjects:	partial charges gcnn force field molecular dynamics openforcefield
Online Access:	Acceder al recurso
Tags:	Add Tag No Tags, Be the first to tag this record!

Similar Items

MOLECULAR REACTIVITY PARAMETERS
by: Lima, Francisco José Santos, et al.
Published: (2007)

Dynamics of Charged Particles and their Radiation Field
by: Spohn, Herbert
Published: (2023)

Vacuum energies and multipole interactions
by: F.A. Barone
Published: (2010)

Non-Markovian decoherence in donor-based charge quantum bits
by: F. Lastra
Published: (2011)

Structural and electro-thermal analysis of a magnetic resonant sensor structure based on Lorentz force
by: E. Morales-González
Published: (2006)

Applications and limitations of the colloid titration method for measuring activated sludge surface charges
by: Haugaard, L
Published: (2003)

The Proton as an Icosahedral Three-Phase Motor
by: Keeble, Clifford
Published: (2026)

Academic women: A study on the queen bee phenomenon
by: Manoel B. Gomes
Published: (2022)

Biomolecules
Published: (2013)

Dynamics and Energetics of a Bromodomain in complex with bromosporine from Leishmania donovani
by: Georcki Ropón-Palacios
Published: (2023)

AlphaDynamics: A compact per-system phase-flow surrogate for protein torsion dynamics
by: Gwozdz, Krzysztof
Published: (2026)

Leynstrinsic Field Theory - Dynamics: Connectivity Field and Emergent Gravity
by: Pillay, Joquin Leyn
Published: (2026)

Molly - A Fast Reader and Writer for the XTC File Format
by: Marieke Westendorp
Published: (2026)

Theoretical Prediction of Physical Properties (Viscosity) on 2D-based Nanofluids
by: José Taha-Tijerina
Published: (2017)

Conformational Ensemble Dynamics of Intrinsically Disordered Full-Length α- and β-Synuclein Monomers
by: Zhongyue, Lv, et al.
Published: (2025)

Current Research in Structural Biology
Published: (2020)

A mídia, o sagrado e as imposturas da imagem: implicações semióticas das charges de Maomé
by: Alberto Klein
Published: (2008)

O corpo do manifestante das Jornadas de Junho de 2013: a charge e o editorial da Folha de São Paulo
by: Marcos Rogério Martins Costa
Published: (2016)

CC×A — Chromatic Context × Aura Dynamics: A Situational Reconstruction Model for Ambient Systems
by: Eissens, Raynor
Published: (2026)

A Unified Framework for Substrate Dynamics
by: Christopher M. Pati
Published: (2026)

Bulking in activated sludge plants treating paper mill wastewaters
by: Thompson, G., Forster, C
Published: (2003)

Smart wireless charging architecture for electric vehicles using resonant inductive coupling and low-component design
by: Mahidhar, Devarakonda, et al.
Published: (2025)

人类第一个精确可解多体引力方程,及天体磁场本源——引力就是库仑力 The First Exactly Soluble Multi-Body Gravitational Equation, the Origin of Astrophysical Magnetic Fields, and Gravity as the Coulomb Force
by: 王江祁
Published: (2026)

CONFINEMENT EFFECTS ON MIXED STATE IN SUPERCONDUCTING PRISMS
by: JOSE JOSE BARBA ORTEGA
Published: (2011)

External Electric Field Effects on Electronic Properties of a Candidate Eco-friendly Biopolymer and Its Anticorrosive Properties in Acidic Media
by: Safari, Reza, et al.
Published: (2021)

(Experiment 3b) Shell crushing force for eastern oysters Crassostrea virginica reared under variable predation conditions (laboratory study)
by: Scherer, Avery E, et al.
Published: (2018)

Mesoscopic simulation of Brownian particles confined in harmonic traps and sheared fluids
by: J. Fernández
Published: (2015)

MD and QM/MM simulation dataset for "Enzymes can activate and mobilize dense biomolecular condensates across scales"
by: Yagi, Kiyoshi, et al.
Published: (2026)

Generative Field Theory: A Unified Variational Formulation of Generativity
by: Doy, David Michael
Published: (2026)

2D radial distribution function of silicene
by: M.R. Chávez-Castillo
Published: (2012)

On the morse potential in liquid phase and at liquid-vapor interface
by: U.F. Galicia-Pimentel
Published: (2006)

AlphaDynamics: A Per-System Phase-Flow Propagator for Protein Torsion Dynamics with Calibrated Rollout Fidelity
by: Gwozdz, Krzysztof
Published: (2026)

AlphaDynamics: A Per-System Phase-Flow Propagator for Protein Torsion Dynamics with Calibrated Rollout Fidelity
by: Gwozdz, Krzysztof
Published: (2026)

A Strontium Titanate Crystal Sphere with Oriented Cobalt Ferrite Inclusions: A QMU–APM Experimental Test Instrument Based on Rotating Magnetic Field Encoding
by: Thomson, David
Published: (2025)

Lightning on Mars (msf:48270): A USP Field Theory Explanation of Dust-Devil Micro-Discharges
by: Sepehri, Sadegh
Published: (2025)

Generative Calculus: A Differential Framework for Possibility, Pattern, and Emergence
by: Doy, David Michael
Published: (2026)

Generative Calculus: A Differential Framework for Possibility, Pattern, and Emergence
by: Doy, David Michael
Published: (2026)

Magnetism as a Structural Routing Constraint in Physical Systems
by: Doumbouya, Lisa Michelle
Published: (2026)

Chaos embedded particle swarm optimization algorithm-based solar optimal ReflexTM frequency charge
by: Jui-Ho Chen
Published: (2015)

In Silico Research in Biomedicine
Published: (2025)