atomes: codeblocks dev files
☆15Jun 12, 2026Updated 2 months ago
Alternatives and similar repositories for atomes
Users that are interested in atomes are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Correlation: A high-performance, Material Design GUI tool for the structural and dynamic analysis of liquids, amorphous solids, and cryst…☆22Aug 4, 2026Updated last week
- This program computes the sum-frequency generation (SFG) spectrum for a give MD trajectory of interfacial water molecules. The program ca…☆13Jul 24, 2023Updated 3 years ago
- A software for mapping energy landscape with a variety of methods, using classical potentials. Based on the LAMMPS MD package.☆12Jan 29, 2021Updated 5 years ago
- ☆24Jul 25, 2021Updated 5 years ago
- A Python/Fortran order parameter analysis library☆14Dec 22, 2020Updated 5 years ago
- Managed Kubernetes at scale on DigitalOcean • AdDigitalOcean Kubernetes includes the control plane, bandwidth allowance, container registry, automatic updates, and more for free.
- Convenience functions for VMD-TCL scripting☆14Apr 3, 2026Updated 4 months ago
- ☆12Sep 24, 2024Updated last year
- Dimethyl ether/Methanol to Olefins (DMTO) is one of the important unit in coal chemical industry, and the distribution of its reaction p…☆11Jul 27, 2022Updated 4 years ago
- CPLAP is a program designed to determine the thermodynamical stability of a material, and, if it is stable, to determine the ranges of th…☆20Oct 29, 2025Updated 9 months ago
- CmuMD implementation for PLUMED2☆24Aug 4, 2023Updated 3 years ago
- Main code repository for the PLUMED-GUI plugin for VMD☆17Jan 22, 2026Updated 6 months ago
- MDANSE: Molecular Dynamics Analysis for Neutron Scattering Experiments☆29Updated this week
- ☆17Jan 2, 2021Updated 5 years ago
- Molecular Dynamics Simulation of Alanine Dipeptide and Dihedral Angle Analysis☆20Jan 2, 2024Updated 2 years ago
- AI Agents on DigitalOcean Gradient AI Platform • AdBuild production-ready AI agents using customizable tools or access multiple LLMs through a single endpoint. Create custom knowledge bases or connect external data.
- A TCL code for the calculation of mass/number density of a system.☆19Jun 21, 2024Updated 2 years ago
- A 3D boid system with accompanying emergent behaviors. Implementation mostly based on Craig Reynolds paper Steering Behaviors For Autonom…☆15Apr 26, 2022Updated 4 years ago
- On-the-fly calculation of Transport Properties☆31Jun 19, 2023Updated 3 years ago
- An automated enhanced sampling generation of training sets for chemically reactive machine learning interatomic potentials☆23Jun 6, 2026Updated 2 months ago
- Julia library to visualize molecules and other chemical structures☆22Jul 15, 2025Updated last year
- Radial Distribution Function(rdf) 镜像分布函数计算☆15Nov 29, 2020Updated 5 years ago
- Extended XYZ read/write support for Julia☆18Jun 17, 2026Updated last month
- Python package for automated transition metal complex conformer generation☆24Dec 4, 2025Updated 8 months ago
- Python module for scientists working with glass materials☆41Jul 1, 2026Updated last month
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- Locally-Weighted Partial Least Squares (LWPLS)☆22Jul 15, 2019Updated 7 years ago
- This software package simulates the reduction of graphene oxide and calculates the optical response of the generated sp2 domains☆11Dec 22, 2016Updated 9 years ago
- Gromacs Topology Files for common Ionic Liquids☆24Jan 24, 2026Updated 6 months ago
- A tool to draw Graphene Oxide 3D chemical structures. (Python 2.7)☆11Nov 27, 2017Updated 8 years ago
- Build atomistic structures of carbon nanotubes with the possibility to add functional groups (OH, COOH, COO-) and assigns generalized Amb…☆24Jan 27, 2020Updated 6 years ago
- Required LAMMPS and MATLAB files for several molecular dynamics simulations.☆48Nov 12, 2021Updated 4 years ago
- Atomistic Topology Operations in Matlab, scripts for manipulation of molecular dynamics or monte carlo simulation systems☆23Nov 27, 2025Updated 8 months ago
- ☆12Jun 26, 2023Updated 3 years ago
- Data, in citable form, produced by the Coudert research group☆46Apr 11, 2026Updated 4 months ago
- Serverless GPU API endpoints on Runpod - Get Bonus Credits • AdSkip the infrastructure headaches. Auto-scaling, pay-as-you-go, no-ops approach lets you focus on innovating your application.
- Modern and fast molecular analysis and modeling library for C++ and Python☆38Apr 21, 2025Updated last year
- Tutorial: Crystallization of silicon using enhanced sampling simulations☆20Mar 6, 2026Updated 5 months ago
- Tool to compute bond and angle force field parameters with the Seminario method☆14Apr 15, 2018Updated 8 years ago
- Molecular dynamics and Monte Carlo simulation package for polymeric and molecular liquids☆35Jul 15, 2022Updated 4 years ago
- Calculates the pair distribution function (PDF) of a POSCAR file.☆12Mar 7, 2016Updated 10 years ago
- Materials Project Tool : An useful tool for manipulating, analying and visualization input and output of materials simulation codes.☆18Dec 8, 2022Updated 3 years ago
- A tutorial code to perform Monte Carlo simulations of patchy particles☆12Dec 1, 2025Updated 8 months ago