Alternatives to LigPlot+

Compare LigPlot+ alternatives for your business or organization using the curated list below. SourceForge ranks the best alternatives to LigPlot+ in 2024. Compare features, ratings, user reviews, pricing, and more from LigPlot+ competitors and alternatives in order to make an informed decision for your business.

  • 1
    SYNTHIA Retrosynthesis Software
    Expert-coded by chemists and engineered by computer scientists, SYNTHIA™ Retrosynthesis Software enables scientists to quickly find and easily navigate innovative and novel pathways for novel and published target molecules. Quickly and efficiently scan hundreds of pathways to help you identify the best option according to your needs. Explore the most cost-effective routes to your target molecules with state of the art visualization and filtering options. Easily customize search parameters to eliminate or promote reactions, reagents or classes of molecules. Explore unique and innovative syntheses that may be unknown for building your desired molecule. Easily generate a list of commercially available starting materials for your synthesis. Benefit from ISO/IEC 27001 Information Security Certification to guarantee the confidentiality, integrity, and protection of your data.
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  • 2
    AutoDock

    AutoDock

    AutoDock

    AutoDock is a suite of automated docking tools. It is designed to predict how small molecules, such as substrates or drug candidates, bind to a receptor of known 3D structure. Over the years, it has been modified and improved to add new functionalities, and multiple engines have been developed. Current distributions of AutoDock consist of two generations of software: AutoDock 4 and AutoDock Vina. More recently, we developed AutoDock-GPU, an accelerated version of AutoDock4 that is hundreds of times faster than the original single-CPU docking code. AutoDock 4 actually consists of two main programs: autodock performs the docking of the ligand to a set of grids describing the target protein; autogrid pre-calculates these grids. In addition to using them for docking, the atomic affinity grids can be visualized. This can help, for example, to guide organic synthetic chemists design better binders.
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    SILCS

    SILCS

    SilcsBio

    Site-Identification by Ligand Competitive Saturation (SILCS) generates 3D maps (FragMaps) of interaction patterns for chemical functional groups with your target molecule. Site-Identification by Ligand Competitive Saturation (SILCS) generates 3D maps (FragMaps) of interaction patterns for chemical functional groups with your target molecule. SILCS reveals intricacies of dynamics and provides tools to optimize ligand scaffolds using qualitative and quantitative binding pockets insights allowing more rapid and effective drug design. SILCS uses multiple small molecule probes with various functional groups, explicit solvent modeling, and target molecule flexibility to perform protein target mapping. Visualize favorable interactions with the target macromolecule. Gain insights to design better ligands with optimally placed functional groups.
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    VeraChem

    VeraChem

    VeraChem

    VeraChem LLC was founded in 2000 to advance the state of the art in computer-aided drug discovery and molecular design by developing computational chemistry methods that are based on cutting-edge basic science but are also applicable in applied science research settings. Efficient high-performance software implementations of these methods coupled with comprehensive user support are a central company strategy for product development. Current VeraChem software capabilities include protein-ligand and host-guest binding affinity prediction, fast calculation of accurate partial atomic charges for drug-like compounds, computation of energies and forces with all the commonly used empirical force fields, automatic generation of alternate resonance forms of drug-like compounds, conformational search with the powerful Tork algorithm, and automatic detection of topological and 3D molecular symmetries. VeraChem’s software packages are constructed from a modular code base.
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    Aurora Drug Discovery

    Aurora Drug Discovery

    Aurora Fine Chemicals

    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.
  • 6
    BioNeMo

    BioNeMo

    NVIDIA

    BioNeMo is an AI-powered drug discovery cloud service and framework built on NVIDIA NeMo Megatron for training and deploying large biomolecular transformer AI models at a supercomputing scale. The service includes pre-trained large language models (LLMs) and native support for common file formats for proteins, DNA, RNA, and chemistry, providing data loaders for SMILES for molecular structures and FASTA for amino acid and nucleotide sequences. The BioNeMo framework will also be available for download for running on your own infrastructure. ESM-1, based on Meta AI’s state-of-the-art ESM-1b, and ProtT5 are transformer-based protein language models that can be used to generate learned embeddings for tasks like protein structure and property prediction. OpenFold, a deep learning model for 3D structure prediction of novel protein sequences, will be available in BioNeMo service.
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    Iktos

    Iktos

    Iktos

    Makya is the first user-friendly SaaS platform for AI-driven de novo drug design focused on Multi-Parametric Optimization (MPO). It enables the design of novel and easy-to-make compounds in line with a multi-objective blueprint with unprecedented speed, performance, and diversity. Makya offers multiple generative algorithms covering different use cases from hit discovery to lead optimization: fine-tuning generator to find optimal solutions within your chemical space in line with your project blueprint; novelty generator to find new ideas with high novelty for re-scaffolding/hit discovery; forward generator to design a focused library of compounds easily accessible from commercial starting materials. The new Makya 3D module enhances the user experience and scientific utility of Makya. With an extensive set of 3D modeling features in both ligand-based and structure-based pipelines, with Makya 3D you can now calculate 3D scores and use these to guide generations natively in Makya.
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    metaphactory

    metaphactory

    metaphacts

    metaphactory transforms your data into consumable, contextual & actionable knowledge and drives continuous decision intelligence. Out-of-the-box, intuitive interfaces for searching, browsing & exploring your Knowledge Graph. Low-code approach to building custom interfaces that enable business-user interaction with the Knowledge Graph. Start small, iterate often & add new use cases, new data and new users on the fly. Agile knowledge management & low-code platform for building applications.
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    Kanteron

    Kanteron

    Kanteron Systems

    Kanteron Platform ingested medical images, digital pathology slides, genomics sequences, and patient data from modalities, scanners, sequencers and databases, and provided a complete data toolkit to every team in hospital networks. Pharmacogenomics for adverse medication event prevention, and Precision Medicine application at the point of care: Incorporates sources of drug-gene interaction data that were previously only available in in accessible formats (e.g. tables in a PDF document), implementing the major Pharmacogenomic databases (like PharmGKB, CGI, DGIdb, OpenTargets...) Allows the user to refine their query to certain gene families, types of interactions, classes of drugs, etc. Flexible AI means you can choose the data set that best fits your use case, and apply it to your relevant medical images.
  • 10
    AlphaFold

    AlphaFold

    DeepMind

    These exquisite, intricate machines are proteins. They underpin not just the biological processes in your body but every biological process in every living thing. They’re the building blocks of life. Currently, there are around 100 million known distinct proteins, with many more found every year. Each one has a unique 3D shape that determines how it works and what it does. But figuring out the exact structure of a protein remains an expensive and often time-consuming process, meaning we only know the exact 3D structure of a tiny fraction of the proteins known to science. Finding a way to close this rapidly expanding gap and predict the structure of millions of unknown proteins could not only help us tackle disease and more quickly find new medicines but perhaps also unlock the mysteries of how life itself works.
  • 11
    NVIDIA Clara
    Clara’s domain-specific tools, AI pre-trained models, and accelerated applications are enabling AI breakthroughs in numerous fields, including medical devices, imaging, drug discovery, and genomics. Explore the end-to-end pipeline of medical device development and deployment with the Holoscan platform. Build containerized AI apps with the Holoscan SDK and MONAI, and streamline deployment in next-generation AI devices with the NVIDIA IGX developer kits. The NVIDIA Holoscan SDK includes healthcare-specific acceleration libraries, pre-trained AI models, and reference applications for computational medical devices.
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    Healnet

    Healnet

    Healx

    Rare diseases are often not well studied and there is a limited understanding of many of the aspects necessary to support a drug discovery program. Our AI platform, Healnet, overcomes these challenges by analyzing millions of drug and disease data points to find novel connections that could be turned into new treatment opportunities. By applying frontier technologies across the discovery and development pipeline, we can run multiple stages in parallel and at scale. One disease, one target, one drug: it's an overly simple model, yet it's the one used by nearly all pharmaceutical companies. The next generation of drug discovery is AI-powered, parallel and hypothesis-free. Bringing together the key three drug discovery paradigms.
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    HyperProtein

    HyperProtein

    Hypercube

    HyperProtein is Hypercube, Inc.'s new product focusing on the computational science associated with protein sequences. The product includes the analysis of one-dimensional protein sequences as well as the analysis of consequent three-dimensional protein structures. In particular, the relationship between sequence and structure is a fundamental facet of the product. Unlike individual software programs that provide capability for some aspect of protein sequence or structure, such as sequence alignment, HyperProtein puts together a multitude of Bioinformatics and Molecular Modeling tools related to the science that initiates with a protein sequence.
  • 14
    Genedata Biologics
    Genedata Biologics® streamlines discovery of biotherapeutics including bispecifics, ADCs, TCRs, CAR-Ts, and AAVs. The most widely adopted platform across the industry, it integrates all discovery workflows so you can focus on true innovation. Accelerate research with a first-in-class platform uniquely designed from the start to digitalize biotherapeutic discovery. The platform facilitates complex R&D processes by designing, tracking, testing, and assessing novel biotherapeutics drugs. It works with any format, from antibodies, bi- or multi-specifics, ADCs, novel scaffolds, and therapeutic proteins, to engineered therapeutic cell lines such as TCRs and CAR-T cells. Acting as a central end-to-end data backbone, Genedata Biologics integrates all R&D processes, from library design and immunizations, selections and panning, molecular biology, screening, protein engineering, expression, purification, and protein analytics, to candidate developability and manufacturability assessments.
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    Dotmatics

    Dotmatics

    Dotmatics

    Dotmatics is the global leader in R&D scientific software that connects science, data, and decision-making. Combining a workflow and data platform with best-of-breed applications, we offer the first true end-to-end solutions for biology, chemistry, formulations, data management, flow cytometry, and more. Trusted by more than 2 million researchers from the world’s leading biopharma, chemicals and materials enterprises, and academic institutions, we are dedicated to working with the scientific community to help make the world a healthier, cleaner and safer place to live. Learn more about our platform and products, including GraphPad Prism, Geneious, SnapGene, Protein Metrics, LabArchives, and more.
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    BIOVIA Discovery Studio

    BIOVIA Discovery Studio

    Dassault Systèmes

    Today’s biopharmaceutical industry is marked by complexity: growing market demands for improved specificity and safety, novel treatment classes and more intricate mechanisms of disease. Keeping up with this complexity requires a deeper understanding of therapeutic behavior. Modeling and simulation methods provide a unique means to explore biological and physicochemical processes down to the atomic level. This can guide physical experimentation, accelerating the discovery and development process. BIOVIA Discovery Studio brings together over 30 years of peer-reviewed research and world-class in silico techniques such as molecular mechanics, free energy calculations, biotherapeutics developability and more into a common environment. It provides researchers with a complete toolset to explore the nuances of protein chemistry and catalyze discovery of small and large molecule therapeutics from Target ID to Lead Optimization.
  • 17
    Eidogen-Sertanty Target Informatics Platform (TIP)
    Eidogen-Sertanty's Target Informatics Platform (TIP) is the world's first structural informatics system and knowledgebase that enables researchers with the ability to interrogate the druggable genome from a structural perspective. TIP amplifies the rapidly expanding body of experimental protein structure information and transforms structure-based drug discovery from a low-throughput, data-scarce discipline into a high-throughput, data-rich science. Designed to help bridge the knowledge gap between bioinformatics and cheminformatics, TIP supplies drug discovery researchers with a knowledge base of information that is both distinct from and highly complementary to information furnished by existing bio- and cheminformatics platforms. TIP's seamless integration of structural data management technology with unique target-to-lead calculation and analysis capabilities enhances all stages of the discovery pipeline.
  • 18
    Mass Dynamics

    Mass Dynamics

    Mass Dynamics

    Discover biological biomarkers, create insights into disease mechanisms, discover new drugs or identify changes in protein levels from a set of carefully designed experiments. We’ve made it easy to start unlocking the power of MS and Proteomics so you can focus on the biological complexity and move closer to the moment of discovery. Our automated and repeatable workflow allows for quicker experiment startup and turnaround times, giving you the control and flexibility to make and act on decisions in the moment. Allowing you to focus on biological insights and human-to-human collaboration, our proteomics data processing workflow is built to scale, repeatedly. We’ve pushed heavy and repetitive processing to the cloud, enabling a seamless and enjoyable experience. Our intelligent Proteomics workflow seamlessly integrates complex moving parts to enable larger experiments to be processed and analyzed with ease.
  • 19
    AIDDISON

    AIDDISON

    Merck KGaA

    AIDDISON™ drug discovery software combines the power of artificial intelligence (AI), machine learning (ML), and 3D computer-aided drug design (CADD) methods to act as a valuable toolkit for medicinal chemistry needs. As a unified platform for efficient and effective ligand-based and structure-based drug design, it integrates all the facets for virtual screening and supports methods for in-silico lead discovery and lead optimization.
  • 20
    PyQtGraph

    PyQtGraph

    PyQtGraph

    PyQtGraph is a pure-python graphics and GUI library built on PyQt/PySide and NumPy. It is intended for use in mathematics/scientific/engineering applications. Despite being written entirely in python, the library is very fast due to its heavy leverage of NumPy for number crunching and Qt's GraphicsView framework for fast display. PyQtGraph is distributed under the MIT open-source license. Basic 2D plotting in interactive view boxes. Line and scatter plots. Data can be panned/scaled by mouse. Fast drawing for real-time data display and interaction. Displays most data types (int or float; any bit depth; RGB, RGBA, or luminance). Functions for slicing multidimensional images at arbitrary angles (great for MRI data). Rapid update for video display or real-time interaction. Image display with interactive lookup tables and level control. Mesh rendering with isosurface generation. Interactive viewports rotate/zoom with mouse. Basic 3D scenegraph for easier programming.
    Starting Price: Free
  • 21
    SpliceCore

    SpliceCore

    Envisagenics

    Using RNA sequencing (RNA-seq) data and Artificial Intelligence are both a necessity and an opportunity to develop therapeutics that target splicing errors. The use of machine learning enables us to discover new splicing errors and quickly design therapeutic compounds to correct them. SpliceCore is our dedicated AI platform for RNA therapeutics discovery. We developed this technology platform specifically for the analysis of RNA sequencing data. It can identify, test and validate hypothetical drug targets faster than traditional methods. At the heart of SpliceCore is our proprietary database of more than 5 million potential RNA splicing errors. It is the largest database of splicing errors in the world and it is used to test every RNA sequencing dataset that is input for analysis. Scalable cloud computing enables us to process massive amounts of RNA sequencing data efficiently, at higher speed and lower cost, exponentially accelerating therapeutic innovation.
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    CDD Vault

    CDD Vault

    Collaborative Drug Discovery

    With CDD Vault, you can intuitively organize chemical structures and biological study data, and collaborate with internal or external partners through an easy to use web interface. Start your free trial and see first hand how easy it is to manage drug discovery data. Tailored for you Affordable Scales with your project team(s) Activity & Registration * Electronic Lab Notebook (ELN) * Visualization * Inventory * APIs * Secure Online Hosting
  • 23
    StarDrop

    StarDrop

    Optibrium

    With its comprehensive suite of integrated software, StarDrop™ delivers best-in-class in silico technologies within a highly visual and user-friendly interface. StarDrop™ enables a seamless flow from the latest data through predictive modeling to decision-making regarding the next round of synthesis and research, improving the speed, efficiency, and productivity of the discovery process. Successful compounds require a balance of many different properties. StarDrop™ guides you through this multi-parameter optimization challenge to target compounds with the best chance of success, saving you time and resources by enabling you to synthesize and test fewer compounds.
  • 24
    Genedata Imagence
    Genedata Imagence® lets you train a deep neural network to classify cellular phenotypes in HCS images for unbiased, high-quality results. It automates your analysis to put the power of deep learning algorithms in the hands of assay biologists. Genedata Imagence empowers biologists to directly and immediately analyze HCS imaging data using sophisticated deep learning techniques without any specialized algorithmic expertise. Don’t shroud your analysis under abstract lines of code. The Genedata Imagence intuitive interface allows you to easily QC and explore data every step of the way.
  • 25
    Elucidata Polly

    Elucidata Polly

    Elucidata

    Harness the power of biomedical data with Polly. The Polly Platform helps to scale batch jobs, workflows, coding environments and visualization applications. Polly allows resource pooling and provides optimal resource allocation based on your usage requirements and makes use of spot instances whenever possible. All this leads to optimization, efficiency, faster response time and lower costs for the resources. Get access to a dashboard to monitor resource usage and cost real time and minimize overhead of resource management by your IT team. Version control is integral to Polly’s infrastructure. Polly ensures version control for your workflows and analyses through a combination of dockers and interactive notebooks. We have built a mechanism that allows the data, code and the environment co-exist. This coupled with data storage on the cloud and the ability to share projects ensures reproducibility of every analysis you perform.
  • 26
    Cortellis

    Cortellis

    Clarivate

    Unlock hidden insights in data using the Cortellis™ suite of life science intelligence solutions – so you can make better informed decisions along the entire R&D lifecycle. We’ve removed the hard work of finding, integrating, and analyzing data so you can focus on the critical decisions needed to get your products to market faster. Applying a unique depth, breadth and quality of data that is enriched with deep domain knowledge, industry understanding, and therapeutic expertise, Cortellis unlocks hidden insights to drive data-driven decisions that accelerate innovation. Get precise, actionable answers to your specific questions across the R&D lifecycle with the broadest and deepest sources of intelligence. Accelerate innovation with Cortellis as an indispensable part of your daily workflow.
  • 27
    NoviSight 3D

    NoviSight 3D

    Olympus

    NoviSight 3D cell analysis software advances your discovery by providing statistical data for spheroids and other 3D objects in microplate-based experiments. The software enables you to quantify cell activity in three dimensions and more easily capture rare cell events, obtain accurate cell counts, and improve detection sensitivity. With a convenient user interface, NoviSight software offers the tools you need for recognition, analysis, and statistics. NoviSight software’s True 3D technology makes it easier to check the morphology of your samples. Measure a range of spheroid or cell nuclei parameters, including volume and sphericity, and measure and analyze physiologically relevant 3D cell models to speed up your research work. The software can analyze objects of interest to provide morphology and spatiotemporal parameters in 3D space. Detect objects from whole structures to subcellular features and evaluate changes in spheroids.
  • 28
    DNAnexus Apollo
    DNAnexus Apollo™ accelerates precision drug discovery by unlocking the power of collaboration to draw critical insights from omics data. Precision drug discovery requires collecting and analyzing huge volumes of omics and clinical data. These datasets are incredibly rich resources, but most legacy and home-grown informatics tools can't cope with their size and complexity. Precision medicine programs can also be hampered by siloed data sources, underpowered collaboration tools, and the burden of complex and always changing regulatory and security requirements. DNAnexus Apollo™ supports precision drug discovery programs by empowering scientists and clinicians to explore and analyze omics and clinical data together, in a single environment, built on a robust, scalable cloud platform. Apollo lets them share data, tools, and analyses easily and securely with peers and collaborators everywhere - whether they're on another floor, or another continent.
  • 29
    Schrödinger

    Schrödinger

    Schrödinger

    Transform drug discovery and materials research with advanced molecular modeling. Our physics-based computational platform integrates differentiated solutions for predictive modeling, data analytics, and collaboration to enable rapid exploration of chemical space. Our platform is deployed by industry leaders worldwide for drug discovery, as well as for materials science in fields as diverse as aerospace, energy, semiconductors, and electronics displays. The platform powers our own drug discovery efforts, from target identification to hit discovery to lead optimization. It also drives our research collaborations to develop novel medicines for critical public health needs. With more than 150 Ph.D. scientists on our team, we invest heavily in R&D. We’ve published over 400 peer-reviewed papers that demonstrate the strength of our physics-based approaches, and we’re continually pushing the limits of computer modeling.
  • 30
    BIOiSIM

    BIOiSIM

    VERISIMLife

    BIOiSIMTM is a first-in-class 'virtual drug development engine' that offers unprecedented value for the drug development industry by narrowing down the number of drug compounds that offer anticipated value for the treatment or cure of specific illnesses or diseases. We offer a range of translational-based solutions, customized for your pre-clinical and clinical programs. These offerings are all centered around our proven and validated BIOiSIMTM platform for small molecules, large molecules, and viruses. Our models are built on data from thousands of compounds across 7 species, leading to robustness rarely seen in the industry. With a focus on human outcomes, the platform has at its core a translatability engine that transforms insights across species. The BIOiSIMTM platform can be used before the preclinical animal trial start, allowing earlier insights and savings in expensive outsourced experimentation.
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    ArgusLab

    ArgusLab

    ArgusLab

    ArgusLab is a molecular modeling, graphics, and drug design program for Windows operating systems. It’s getting a little dated by now, but remains surprisingly popular. To date, there are more than 20,000 downloads. ArgusLab is freely licensed. You don’t need to sign anything. You can use as many copies as you need if you are teaching a class where your students might benefit from using ArgusLab. You are not allowed to redistribute ArgusLab from other websites or sources. However, you may link to this website from your own websites if you like. A low-key effort is currently underway to port ArgusLab to the iPad. In addition, I’ve done some work with the Qt cross-platform development environment in an effort to support Mac, PC, and Linux.
    Starting Price: Free
  • 32
    FCS Express

    FCS Express

    De Novo Software

    FCS Express™ gets you from raw data to easily-understandable, beautifully formatted, presentation-ready results more easily and in less time than any other flow cytometry software. If you've ever had to copy and paste tables of data into a more user-friendly software just to get your data into a visual format that looked good and was comprehensible. If you’ve ever had to manage your data across multiple software packages - your flow cytometry software as well as something like Microsoft Excel™ or GraphPad Prism™ because you couldn’t get everything you needed in one place. Learning how to use flow cytometry software should not be an impediment to getting results from your data. FCS Express is designed to look, feel, and work like many familiar Microsoft Office™ programs so you are already halfway to being an expert with the software before you even get started.
    Starting Price: $53 per month
  • 33
    Genomenon

    Genomenon

    Genomenon

    Pharma companies need comprehensive genomic information to drive successful precision medicine programs, but decisions are often made using only a fraction of the data available, about 10%. Genomenon delivers 100% of the data. An efficient and cost-effective natural history research solution for pharma, ProdigyTM Patient Landscapes support the development of rare disease therapies by enhancing insights contained in retrospective and prospective health data. Using a powerful AI-driven approach, Genomenon delivers a comprehensive and expert assessment of every patient in the published medical literature, in a fraction of the time. Don’t miss anything, get insight into every genomic biomarker published in the medical literature. Every scientific assertion is supported by empirical evidence from the medical literature. Identify all genetic drivers and pinpoint which variants are known to be pathogenic according to ACMG clinical standards.
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    DrugPatentWatch

    DrugPatentWatch

    DrugPatentWatch

    Global biopharmaceutical drug patent and generic entry business intelligence. Anticipate future budget requirements and proactively identify generic sources. Assess past successes of patent challengers and elucidate research paths of competitors. Inform portfolio management decisions on future drug development. Predict branded drug patent expiration, identify generic suppliers, and prevent overstock of branded drugs. Obtain formulation and manufacturing information; identify final formulators, repackagers, and relabelled.
    Starting Price: $250 per month
  • 35
    adWATCH

    adWATCH

    Atlant Systems

    adWATCH - AE helps pharmaceutical organizations manage and report adverse events that occur during clinical trials. adWATCH - AE gives the reporter at a clinic, hospital, or investigative site a fast and effective means of generating and managing Adverse Event Reports (AERs) and reporting to the regulatory departments and government agencies. An adverse effect is a negative or dangerous effect experienced by a patient and caused by drugs and/or medical devices. Adverse event reporting requires the tracking of all medical complaint case information, resulting in the generation of MedWatch reports, CIOMS reports and additional reports for management. adWATCH - AE allows researchers, physician investigators, Contract Research Organizations (CROs), clinical trial specialists, and other health professionals to produce and file AERs in the FDA mandated MedWatch and/or CIOMS format.2
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    Recursion

    Recursion

    Recursion

    We are a clinical-stage biotechnology company decoding biology by integrating technological innovations across biology, chemistry, automation, machine learning and engineering to industrialize drug discovery. Increased control over biology with tools such as CRISPR genome editing and synthetic biology. Reliable automation of complex laboratory research at an unprecedented scale using advanced robotics. Iterative analysis of, and inference from, large, complex in-house datasets using neural network architectures. Increasing elasticity of high-performance computation using cloud solutions. We are leveraging new technology to create virtuous cycles of learning around datasets to build a next-generation biopharmaceutical company. A synchronized combination of hardware, software and data used to industrialize drug discovery. Reshaping the traditional drug discovery funnel. One of the largest, broadest and deepest pipelines of any technology-enabled drug discovery company.
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    BC Platforms

    BC Platforms

    BC Platforms

    BC platforms leverages latest science, unique technology capabilities, and strategic partnerships to achieve our mission of revolutionizing drug discovery and personalizing care. Modular, highly configurable platform for integrated healthcare data. Open analytics framework seamlessly combining latest innovative methods, analytics and technology developments in one single platform. Superior security: ISO 27001 certified, GDPR and HIPAA compliance. Complete product portfolio enabling a modern healthcare system to fully embrace personalized medicine. Scalable deployments enabling a robust start as well as large scale healthcare operation. Accelerated translation of research insights into clinical practice with our unique end to end toolbox. We help reduce your risk, enhance your pipeline value and advance your enterprise data strategy by solving the barriers of data access and enabling rapid insight generation.
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    YASARA

    YASARA

    YASARA

    YASARA is a molecular graphics, modeling, and simulation program for Windows, Linux, MacOS, and Android developed in 1993, that finally makes it really easy to answer your questions. With an intuitive user interface, photorealistic graphics, and support for affordable virtual reality headsets, shutter glasses, autostereoscopic displays, and input devices, YASARA creates a new level of interaction with the 'artificial reality', that allows you to focus on your goal and forget about the details of the program. YASARA is powered by PVL (Portable Vector Language), a new development framework that provides performance way above traditional software. PVL allows you to visualize even the largest proteins and enables true interactive real-time simulations with highly accurate force fields on standard PCs, making use of GPUs if available. You can push and pull molecules around and work with dynamic models instead of static pictures.
    Starting Price: Free
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    Ascalaph Designer

    Ascalaph Designer

    Agile Molecule

    Ascalaph Designer is a general-purpose program for molecular dynamic simulations. Under a single graphical environment are represented as their own implementation of molecular dynamics as well as the methods of classical and quantum mechanics of popular programs. Molecular geometry optimization with conjugate gradient methods. Shows molecular models in separate windows. Each window has two cameras, which allow the model to be simultaneously visualized from two sides and in different graphic modes. The subwindow can be opened by dragging the splitter in the right corner of each graphical window. Clicking on an atom or bond with the left mouse button slightly changes their color and a brief info about the picked object appears in the status bar. The wire-frame style is convenient for large molecules, particularly, proteins. Drawing is very fast for this style. Finally, CPK wire frame combines the properties of several above styles.
    Starting Price: Free
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    Fatigue Essentials
    Fatigue Essentials is a desktop application used to efficiently conduct structural fatigue analysis. Fatigue Essentials provides a user-friendly tool for conducting stress-life analysis either using classical stress calculations or linked with FEMAP™ and using the finite element generated stresses. The program is structured to guide the user through the analysis by following a tree structure. General analysis options are selected following loads, materials, and spectrum branches. Within each branch are options for analysis variations or input methods. Analysis results are available on-screen to paste into a report and/or as a damage contour plot in FEMAP. Covers most engineering requirements. Classic mode with user input stresses. Professional mode (FEMAP-linked) with the ability to read nodal stresses and push back results in a damage contour plot. Option for either interactive input or file input for stresses and cycles.
    Starting Price: $695 one-time payment
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    CircuitLab

    CircuitLab

    CircuitLab

    Easy-wire mode lets you connect elements with fewer clicks and less frustration. Unit-aware expression evaluation lets you plot arbitrary signals of interest, such as differential signals or power dissipation. In-browser simulation and plotting lets you design and analyze faster, making sure your circuit works before ever picking up a soldering iron. Advanced simulation capabilities include frequency-domain (small signal) simulation, stepping circuit parameters through a range, arbitrary Laplace transfer function blocks, and more. Work with multiple signals easily with configurable plotting windows, vertical and horizontal markers, and calculations on signals. Draw generic rectangular symbols for IC or system-level wiring diagrams with just a few clicks.
    Starting Price: $24 per year
  • 42
    CoPlot

    CoPlot

    CoHort Software

    CoPlot Version 6.45 is an incredibly versatile program for making publication-quality 2D and 3D scientific graphs (which plot data and equations), maps, and technical drawings. Every aspect of CoPlot has been designed around one basic goal: to make a program that is so versatile that scientists and engineers can easily get exactly what they want. CoPlot includes CoStat for data handling and statistics. Create precise technical drawings with CoPlot's versatile drawing objects. CoPlot is ideal for creating genetic maps, field maps, flow charts, apparatus diagrams, circuit diagrams, chemical structures, etc. See the sample drawings.The text in drawing objects and graphs can include HTML-like text formatting tags and over 1000 special characters. Make great scientific graphs and maps. CoPlot has seven basic types of graphs, over 40 ways of plotting data, 18 ways to plot equations, incredibly flexible attributes, asymmetric and horizontal error bars, 12 different axis types, etc.
    Starting Price: $280 one-time payment
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    EveryCircuit

    EveryCircuit

    EveryCircuit

    One animated circuit is worth a thousand equations and diagrams. Animations of voltages, currents, and charges are displayed right on top of the schematic, providing great insight into circuit operation. The real-time circuit simulation engine is custom-built for speed and interactivity. Easy one-click simulation, from simple resistors and logic gates to complex transistor-level oscillators and mixed-signal designs. While the simulation is running, you can flip switches, adjust potentiometers, tune LED current limiting resistors, ramp up input voltages, etc. The circuit will immediately respond to your changes, in real time. Mini-waveforms on top of schematic wires look different for digital and analog signals. Constant analog voltages are shown as numbers, digital wires are color-coded. Any pair of time-domain signals may be plotted in the XY mode. The oscilloscope scale and grid ticks are auto-updated to convenient values as the data changes.
    Starting Price: $15 one-time payment
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    SPC XL

    SPC XL

    SigmaZone

    XbarR, XbarS, Individuals, n, p, u, and np Charts. Update charts after they've been created. Identify outliers and have them displayed without affecting the control limiits. Histogram, Capability Analysis (Cpk), Scatter Plot (with regression fitting), Pareto, Dot Plot, Box Plots, Multiple Regression, Hypothesis Testing, Confidence Intervals, and Sample Size Calculations. Measurement System Analysis (Gage R&R) for both Quantitative and Binomial Data, Cause and Effect Diagram, Main Effects Plots, Cusum, Product Capability, FMEA, and Distribution Calculators.
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    Maple Flow

    Maple Flow

    Maplesoft

    Maple Flow is a mathematics tool that makes it easy for engineers to brainstorm, develop, and document their design calculations. Combining a simple, freeform interface with a comprehensive math engine, Maple Flow provides a whiteboard-style environment that automatically keeps calculations live as users refine, reposition, and develop their work. Do calculations, write documentation and easily refine your work in an environment that does not feel like a programming tool or a spreadsheet. Place math, text, images, or plots wherever you wish, and reposition your work with the mouse or keyboard – Maple Flow keeps everything organized behind the scenes. Maple Flow contains all the powerful features that technical professionals expect in a calculation tool, with fast solvers, built-in units tracking, flexible plots, and more.
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    StarUML

    StarUML

    StarUML

    Compatible with UML 2.X standard metamodel and diagrams: class, object, use case, component, deployment, composite structure, sequence, communication, statechart, activity, timing, interaction overflow, information flow and profile diagram. Support modeling with SysML diagrams: requirement, block definition, internal block, and parametric diagram. Supports Retina (High-DPI) Display. All diagrams, texts and icons are razor sharp and can be exported to High-DPI images (PNG and JPEG). Easily discover and install third-party extensions. Many extensions are open source and hosted on Github. Supports many shorthands in Quick Edit to create elements and relationships at once such as sub-classes, supporting interfaces, etc.
    Starting Price: $99 per user
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    Renishaw MODUS

    Renishaw MODUS

    Renishaw

    Renishaw's MODUS software provides a powerful platform for 5‑axis measurement. A configurable user interface allows native DMIS programs to be developed offline, drawing geometry, embedded dimensions, and tolerance data from CAD, with full simulation. The software includes certified algorithms for feature measurement, feature construction, and part alignment. Programs can be created offline directly from CAD with on-screen probe path verification. The CMM environment, the fixture, and the location of the part on the machine can all be defined, enabling full simulation of 5‑axis measurement programs. This minimizes CMM downtime as programs arrive at the machine ready to run, with little or no prove-out time required. The reporting capability of MODUS is extensive, including traditional CMM text reports with comprehensive user-defined formatting. Graphical reporting enables results to be displayed against the CAD model, including whisker charts or 3D form plotting for many features.
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    Beaker Notebook

    Beaker Notebook

    Two Sigma Open Source

    BeakerX is a collection of kernels and extensions to the Jupyter interactive computing environment. It provides JVM support, Spark cluster support, polyglot programming, interactive plots, tables, forms, publishing, and more. All of BeakerX’s JVM languages plus Python and JavaScript have APIs for interactive time-series, scatter plots, histograms, heatmaps, and treemaps. The widgets remain interactive in both notebooks saved to disk, and notebooks published to the web. They include unique features for handling many points, nanosecond resolution, zooming, and exporting. BeakerX’s table widget automatically recognizes pandas data frames and allows you to search, sort, drag, filter, format, select, graph, hide, pin, and export to CSV or clipboard. This makes connecting to spreadsheets quickly and easy. BeakerX has a Spark magic with GUIs for configuration, status, progress, and interrupt of Spark jobs. You can either use the GUI or create your own SparkSession with code.
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    LogPlot8

    LogPlot8

    RockWare, Inc.

    LogPlot is an easy-to-use log plotting program with a flexible log layout and intuitive data editor. LogPlot software has been used by geoscientists since 1983 to display their geotechnical, environmental, geophysical, mud/gas, and mining data as a graphic boring log. Plot single-page logs for shallow borings or multi-page/continuous logs for deep wells. Share logs with clients via PDF or post HTML log pages on your website. Export single pages or continuous logs to JPG, BMP, TIFF, and PNG images.
    Starting Price: $899.00
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    CSols AqcTools
    CSols AqcTools™ v2.6 allows users to dynamically display Analytical Quality Control (AQC) charts to monitor lab performance, provides paper-free, auditable investigations of control limit failures, includes comprehensive reports and reduces the time to assess and process your QC data. Customers in water, environmental, public health sector and industrial laboratories undertaking chemical, clinical and microbiological analysis will benefit from AqcTools. It provides a selection of ‘dynamic, interactive’ charts from the standard ‘individual plotted AQC points’ to charts that can use batch or daily means of data, for both current and historic data. In addition, users can plot charts for an individual analyst to support the labs on-going analyst competency checking. All of the information relating to each individual point such as date, batch number, analyst, instrument etc. is just one mouse click away.