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Name: Martin (Mino) Olsson
Type: User
Company: Forcelab
Bio: PhD, Theoretical Chemistry MSc, Engineering Nanoscience
Location: Lund, Sweden
Name: Martin (Mino) Olsson
Type: User
Company: Forcelab
Bio: PhD, Theoretical Chemistry MSc, Engineering Nanoscience
Location: Lund, Sweden
A python module for manipulating cartesian and internal coordinates.
Generate electrostatic potential surfaces using the output from Astex's ESP_DNN method
A Graph-Convolutional Deep Neural Network for predicting electrostatic potential surfaces
grand unified free energy by OpenFE
Inference code for Llama models
An open library for the analysis of molecular dynamics trajectories
Contains the modified Seminario method program along with set of example files.
Calculating Modified Seminario Method Bond and Angle parameters from QCArchive
python scripts for machine learning potentials
The Open Free Energy toolkit
The Open Forcefield Toolkit provides implementations of the SMIRNOFF format, parameterization engine, and other tools. Documentation available at http://open-forcefield-toolkit.readthedocs.io
CHARMM and AMBER forcefields for OpenMM (with small molecule support)
A batteries-included toolkit for the GPU-accelerated OpenMM molecular simulation engine.
Torsion force field parameters from Psi4 frequency calculation
A Python program for QM/MM Simulations based on the Perturbed Matrix Method
Quantum Mechanical Bespoke Force Field Derivation Toolkit
A. Alenaizan's restricted electrostatic potential (RESP) plugin to Psi4
Tool to compute bond and angle force field parameters with the Seminario method
A declarative, efficient, and flexible JavaScript library for building user interfaces.
🖖 Vue.js is a progressive, incrementally-adoptable JavaScript framework for building UI on the web.
TypeScript is a superset of JavaScript that compiles to clean JavaScript output.
An Open Source Machine Learning Framework for Everyone
The Web framework for perfectionists with deadlines.
A PHP framework for web artisans
Bring data to life with SVG, Canvas and HTML. 📊📈🎉
JavaScript (JS) is a lightweight interpreted programming language with first-class functions.
Some thing interesting about web. New door for the world.
A server is a program made to process requests and deliver data to clients.
Machine learning is a way of modeling and interpreting data that allows a piece of software to respond intelligently.
Some thing interesting about visualization, use data art
Some thing interesting about game, make everyone happy.
We are working to build community through open source technology. NB: members must have two-factor auth.
Open source projects and samples from Microsoft.
Google ❤️ Open Source for everyone.
Alibaba Open Source for everyone
Data-Driven Documents codes.
China tencent open source team.