| Package Name | Access | Summary | Updated |
|---|---|---|---|
| openmm-example-plugin | public | An example plugin for openmm | 2025-03-25 |
| meld-plugin | public | No Summary | 2025-03-25 |
| eigen3 | None | C++ template library for linear algebra | 2025-03-25 |
| hdf5-1814 | None | HDF5 pinned at 1.8.14, for use with Modeller | 2025-03-25 |
| autoprotocol | public | Python library for generating Autoprotocol | 2025-03-25 |
| shiftx2 | public | SHIFTX2 predicts both the backbone and side chain 1H, 13C and 15N chemical shifts for proteins using their structural (PDB) coordinates as input. | 2025-03-25 |
| osprey | public | |Build Status| |PyPi version| |Supported Python versions| |License|\n|Documentation Status| | 2025-03-25 |
| gpy | public | No Summary | 2025-03-25 |
| paramz | public | The Parameterization Framework | 2025-03-25 |
| openmm-beta | public | A high performance toolkit for molecular simulation. | 2025-03-25 |
| nglview | public | IPython widget to interactively view molecular structures and trajectories. | 2025-03-25 |
| simpletraj | public | Lightweight coordinate-only trajectory reader based on code from GROMACS, MDAnalysis, VMD. | 2025-03-25 |
| deepchem | public | Deep-learning models for Drug Discovery and Quantum Chemistry | 2025-03-25 |
| keras | public | Theano-based Deep Learning library | 2025-03-25 |
| theano | public | Optimizing compiler for evaluating mathematical expressions on CPUs and GPUs. | 2025-03-25 |
| sphinxcontrib-autodoc_doxygen | public | Doxygen / Sphinx bridge, with autodoc and autosummary | 2025-03-25 |
| sphinxcontrib-lunrsearch | public | Instant search for Sphinx | 2025-03-25 |
| cpptraj | public | Biomolecular simulation trajectory/data analysis. | 2025-03-25 |
| arpack | public | ARPACK is a collection of Fortran77 subroutines designed to solve large scale eigenvalue problems. | 2025-03-25 |
| torsionfit-dev | public | A toolkit for Bayesian torsion parameterization for molecular mechanics forcefields. | 2025-03-25 |
| ccache | public | ccache is a compiler cache. It speeds up recompilation by caching previous compilations and detecting when the same compilation is being done again. | 2025-03-25 |
| progressbar | public | No Summary | 2025-03-25 |
| autograd | public | Efficiently computes derivatives of numpy code. | 2025-03-25 |
| hmmlearn | public | Hidden Markov Models in Python with scikit-learn like API | 2025-03-25 |
| ipynbtest | public | No Summary | 2025-03-25 |
