CheUP Files

Gromacs Topology Builder - OPLS AA Based. Support many charge model

Brought to you by: khabibki06

The interactive file manager requires Javascript. Please enable it or use sftp or scp.
You may still browse the files here.

Name	Modified	InfoDownloads / Week
Parent folder
version 1.0b3	2020-11-15	0
Totals: 1 Item		0

Other Useful Business Software

MongoDB Atlas runs apps anywhere

Deploy in 115+ regions with the modern database for every enterprise.

MongoDB Atlas gives you the freedom to build and run modern applications anywhere—across AWS, Azure, and Google Cloud. With global availability in over 115 regions, Atlas lets you deploy close to your users, meet compliance needs, and scale with confidence across any geography.

Start Free

Build Data Resilience - Take the Assessment Today

Can you recover when it matters most? Take this quick assessment to identify gaps and build greater recovery confidence.

Is your recovery strategy as strong as you think? Take this quick self-assessment to check your recovery readiness and gain tailored insights. In only 2 minutes, you'll learn where you fall on the recovery readiness scale.

Take the Assessment

Recommended Projects

GromacsProSuite
Graphical User Interface for Gromacs
Ascalaph Quantum
is a molecular viewer & model builder for quantum chemistry programs. It has an interface with NWChem, CP2K and PC GAMESS/Firefly quantum programs. http://www.biomolecular-modeling.com/Products.html
Molecular Viewer and Editor in Java
MolStart is a molecular structure viewer and editor in Java. MolStart reads xyz, PDB, tinker, car and Gaussian input files. MolStart also includes force field parameters for protein and DNA atomic typing to add Hydrogen atoms.
ForceGen
Derives force constants from Gaussian QM for Gromacs MD
PL: Piecewise-linear topology using GAP
This is a project aiming at creating programs for calculations in piecewise linear topology and mathematical physics—finite-dimensional topological quantum field theories—using GAP computer algebra system.