Search

Categories

Biological and Medicinal Chemistry

(1)

Physical Chemistry

(2)

Theoretical and Computational Chemistry

(3)

Content Types

Working Paper

(3)

Published Date

Over 3 years

(1)

Last 3 years

(2)

Keywords

coarse grain

Authors

3 results in Keywords: coarse grain

Theoretical and Computational Chemistry

Systematic bottom-up molecular coarse-graining via force and torque matching using anisotropic particles

David Huang, Huong Nguyen

Version 2 posted 05 April 2022

807

Downloads

Theoretical and Computational Chemistry

Modeling coarse-grained van der Waals interactions using dipole-coupled anisotropic quantum Drude oscillators

Prasanta Bandyopadhyay, Mainak Sadhukhan

Version 1 posted 02 August 2022

249

Downloads

Physical Chemistry

Soft Matter under Pressure: Pushing Particle-Field Molecular Dynamics to the Isobaric Ensemble

Samiran Sen, Morten Ledum, Sigbjørn Løland Bore, Michele Cascella

Version 1 posted 06 February 2023

605

Downloads