Audience

Computational chemists and materials scientists in search of a solution to accelerate drug discovery and materials development through automated, scalable, and high-fidelity modeling

About QSimulate

QSimulate offers a suite of quantum simulation platforms that leverage quantum mechanics to solve complex, industrial-scale problems in life sciences and materials science. The QSP Life platform provides unique quantum-powered methods for drug discovery and optimization, enabling first-of-a-kind quantum simulations of ligand-protein interactions applicable throughout the computational drug discovery process. The QUELO platform performs hybrid quantum/classical free energy calculations, offering users the ability to run relative free energy calculations using the free energy perturbation (FEP) approach. Additionally, QSimulate's technology enables groundbreaking advances in quantum mechanics/molecular mechanics (QM/MM) simulations for large protein modeling. For materials science, the QSP Materials platform democratizes quantum mechanical simulations, allowing experimentalists to automate complex workflows without the need for specialization.

Other Popular Alternatives & Related Software
LIQUi|>
LIQUi|>
LIQUi|> is a software architecture and tool suite for quantum computing. It includes a programming language, optimization and scheduling algorithms, and quantum simulators. LIQUi|> can be used to translate a quantum algorithm written in the form of a high-level program into the low-level machine instructions for a quantum device. LIQUi|> is being developed by the quantum architectures and computation Group (QuArC) at Microsoft Research. To aid in the development and understanding of quantum protocols, quantum algorithms, quantum error correction, and quantum devices, QuArC has developed an extensive software platform called LIQUi|>. LIQUi|> allows the simulation of Hamiltonians, quantum circuits, quantum stabilizer circuits, and quantum noise models, and supports client, service, and cloud operation.
Learn more
Amazon Braket
Amazon Braket
Easily work with different types of quantum computers and circuit simulators using a consistent set of development tools. Build quantum projects on a trusted cloud with simple pricing and management controls for both quantum and classical workloads. Run hybrid quantum-classical algorithms faster with priority access to quantum computers and no classical infrastructure to manage. Reserve dedicated device access and engage directly with quantum computing specialists using Braket Direct. Accelerate scientific discovery with tools for algorithm development and support from the AWS Cloud Credit for Research Program. Push the boundaries of quantum hardware research with easy access to superconducting, trapped ion, and neutral atom devices. Bring software for quantum computing to market rapidly with Amazon Braket’s software development kit, simple pricing, and workflow management.
Learn more
Aurora Drug Discovery
Aurora Drug Discovery
Aurora employs quantum mechanics, thermodynamics, and an advanced continuous water model for solvation effects to calculate ligand´s binding affinities. This approach differs dramatically from scoring functions that are commonly used for binding affinity predictions. By including the entropy and aqueous electrostatic contributions in to the calculations directly, Aurora algorithms produce much more accurate and robust values of binding free energies. Interaction of a ligand with a protein is characterized by the value of binding free energy. The free energy (F) is the thermodynamic quantity that is directly related to experimentally measurable value of inhibition constant (IC50) and depends on electrostatic, quantum, aqueous solvation forces, as well as on statistical properties of interacting molecules. There are two major contributing quantities leading to non-additivity in F: 1) the electrostatic and solvation energy and 2) the entropy.
Learn more
QX Simulator
QX Simulator
The realization of large-scale physical quantum computers appears to be challenging, alongside the efforts to design quantum computers, significant efforts are focusing on the development of useful quantum algorithms. In the absence of a large physical quantum computer, an accurate software simulation of quantum computers on a classical computer is required to simulate the execution of those quantum algorithms and to study the behavior of a quantum computer and improve its design. Besides simulating error-free execution quantum circuits on a perfect quantum computer, the QX simulator can simulate realistic noisy execution using different error models such as the depolarizing noise. The user can activate the error model and define a physical error probability to simulate a specific target quantum computer. This error rate can be defined based on the gate fidelity and the qubit decoherence of the target platform.
Learn more

Integrations

No integrations listed.

Ratings/Reviews

Overall 0.0 / 5
ease 0.0 / 5
features 0.0 / 5
design 0.0 / 5
support 0.0 / 5

This software hasn't been reviewed yet. Be the first to provide a review:

Review this Software

Company Information

QSimulate
United States
qsimulate.com/home

Videos and Screen Captures

Play Video QSimulate Screenshot 1
Other Useful Business Software
Our Free Plans just got better! | Auth0 Icon
Our Free Plans just got better! | Auth0

With up to 25k MAUs and unlimited Okta connections, our Free Plan lets you focus on what you do best—building great apps.

You asked, we delivered! Auth0 is excited to expand our Free and Paid plans to include more options so you can focus on building, deploying, and scaling applications without having to worry about your security. Auth0 now, thank yourself later.
Try free now

Product Details

Platforms Supported
Cloud
Training
Documentation
Live Online
In Person
Videos
Support
Phone Support
Online

QSimulate Frequently Asked Questions

Q: What kinds of users and organization types does QSimulate work with?
Q: What languages does QSimulate support in their product?
Q: What kind of support options does QSimulate offer?
Q: What type of training does QSimulate provide?

QSimulate Product Features

QSimulate Additional Categories