| Name | Version | Summary | date |
| EasyMDA |
0.3.4 |
Easy MD Analysis (EMDA) is a Python package created with the aim of providing an easy, yet powerful way to perform analysis of MD simulations. |
2024-02-26 19:13:48 |
| pmd |
1.5.2 |
Automated generation of LAMMPS data and input files for polymer molecular dynamics simulations |
2024-02-22 14:15:04 |
| libpyvinyl |
1.2.0 |
The python API for photon and neutron simulation codes in the Photon and Neutron Open Science Cloud (PaNOSC). |
2024-02-06 10:14:21 |
| bk7084 |
0.3.15 |
Python framework for BK7084 Computational Simulations |
2024-01-09 18:11:08 |
| mdakit-sasa |
0.2.6 |
This kit allows the calculation of a solvent-accessible-surface area of a trajectory |
2023-12-29 20:34:29 |
| ullyses-utils |
3.1.0 |
ULLYSES utility files and scripts |
2023-12-13 18:06:30 |
| graforvfl |
1.0.0 |
GrafoRVFL: A Python Library for Maximizing Performance of Random Vector Functional Link Network with Gradient-Free Optimization |
2023-12-05 02:16:19 |
| metaperceptron |
1.1.0 |
MetaPerceptron: Unleashing the Power of Metaheuristic-optimized Multi-Layer Perceptron - A Python Library |
2023-12-03 03:15:51 |
| epyt |
1.0.8 |
EPyT: An EPANET-Python Toolkit for Smart Water Network Simulations. The EPyT is inspired by the EPANET-Matlab Toolkit. |
2023-11-29 19:08:49 |
| reflame |
1.0.1 |
Revolutionizing Functional Link Neural Network by Metaheuristic Algorithms: reflame - A Python Library |
2023-11-26 04:21:07 |
| metacluster |
1.2.0 |
MetaCluster: An Open-Source Python Library for Metaheuristic-based Clustering Problems |
2023-11-10 16:20:09 |
| mdaencore |
1.0.0 |
Ensemble overlap comparison software for molecular data. |
2023-11-09 23:15:01 |
| mealpy |
3.0.1 |
MEALPY: An Open-source Library for Latest Meta-heuristic Algorithms in Python |
2023-11-05 09:33:17 |
| vice |
1.3.1 |
Galactic Chemical Evolution Integrator |
2023-10-25 22:40:32 |
| waterdynamics |
1.0.0 |
Analysis of water dynamics in molecular dynamics trajectories and water interactions with other molecules. |
2023-10-18 19:31:21 |
| transport-analysis |
0.1.0 |
A Python package to compute and analyze transport properties. |
2023-10-08 07:52:23 |
| Corrfunc |
2.5.2 |
Blazing fast correlation functions on the CPU |
2023-10-03 23:28:43 |
| aasm |
0.1.9 |
Agents Assembly translator |
2023-09-05 15:58:09 |
| mafese |
0.1.9 |
MAFESE: Metaheuristic Algorithm for Feature Selection - An Open Source Python Library |
2023-08-07 11:14:05 |
| BMCTool |
0.6.1 |
A python tool to perform Bloch-McConnell (BMC) simulations. |
2023-07-03 13:50:29 |