ismaelresp

Computational Receptor Biology Group, Department of Drug Design and Pharmacology, University of CopenhagenCopenhagen, Denmark

Pinned Repositories

gpcrmd_data
DB dumps and other data, git lfs required
Language:Python01
MD-protocol
System building protocol for GPCRmd molecular dynamics
Language:Rich Text Format5 2 03
AlloViz
A Python package to interactively compute, analyze and visualize protein allosteric communication (residue interaction) networks and delta-networks.
Language:Python0 0 00
docker-postgres-rdkit
PostgreSQL Docker image with RDKit cartridge
Language:Shell00
flame
Modeling framework for eTransafe project
Language:Python00
Flame_installer_linux
Bash scripts for installing Flame and miniconda
Language:Shell00
gpcrdb_data
This repository is the collection point of reference data for the GPCRdb. The GPCRdb contains reference data, interactive visualisation and experiment design tools for G protein-coupled receptors (GPCRs).
Language:HTML00
protwis
Protwis is the backbone of the GPCRdb. The GPCRdb contains reference data, interactive visualisation and experiment design tools for G protein-coupled receptors (GPCRs).
Language:Python00
RAcount
Language:TypeScript0 2 00
RAcountServer
Language:JavaScript0 3 00

ismaelresp/AlloViz
A Python package to interactively compute, analyze and visualize protein allosteric communication (residue interaction) networks and delta-networks.
Language:Python0 0 00
ismaelresp/docker-postgres-rdkit
PostgreSQL Docker image with RDKit cartridge
Language:Shell00
ismaelresp/flame
Modeling framework for eTransafe project
Language:Python00
ismaelresp/Flame_installer_linux
Bash scripts for installing Flame and miniconda
Language:Shell00
ismaelresp/gpcrdb_data
This repository is the collection point of reference data for the GPCRdb. The GPCRdb contains reference data, interactive visualisation and experiment design tools for G protein-coupled receptors (GPCRs).
Language:HTML00
ismaelresp/htmd
High throughput molecular dynamics simulations
Language:Python0 1 00
ismaelresp/mdsrv
MD trajectory server
Language:Python00
ismaelresp/protwis
Protwis is the backbone of the GPCRdb. The GPCRdb contains reference data, interactive visualisation and experiment design tools for G protein-coupled receptors (GPCRs).
Language:Python00
ismaelresp/PyEMMA
Markov state model algorithms
Language:Python00
ismaelresp/sqlitebrowser
Official home of the DB Browser for SQLite (DB4S) project. Previously known as "SQLite Database Browser" and "Database Browser for SQLite". Website at:
Language:C++00
ismaelresp/vmd-python
Installable VMD as a python module
Language:C00