How do you check if your #QSAR/#QSPR model captures real relationships and not chance correlations?
Learn how to perform a Y-Randomization (Y-Scrambling) test in alvaModel with our short video tutorial.
🎥 youtube.com/watch?v=jrmk...
🔗 alvascience.com/alvamodel/
#MachineLearning #chemsky
Learn how to perform a Y-Randomization (Y-Scrambling) test in alvaModel with our short video tutorial.
🎥 youtube.com/watch?v=jrmk...
🔗 alvascience.com/alvamodel/
#MachineLearning #chemsky
alvaModel Y-Randomization
YouTube video by Alvascience
youtube.com
June 12, 2026 at 9:01 AM
How do you check if your #QSAR/#QSPR model captures real relationships and not chance correlations?
Learn how to perform a Y-Randomization (Y-Scrambling) test in alvaModel with our short video tutorial.
🎥 youtube.com/watch?v=jrmk...
🔗 alvascience.com/alvamodel/
#MachineLearning #chemsky
Learn how to perform a Y-Randomization (Y-Scrambling) test in alvaModel with our short video tutorial.
🎥 youtube.com/watch?v=jrmk...
🔗 alvascience.com/alvamodel/
#MachineLearning #chemsky
Prediction Detail go beyond the predicted value.
With alvaModel, you can visualize atomic and fragment contributions and, for KNN models, inspect the nearest neighbour compounds used for the prediction.
🎥 Watch the video:
www.youtube.com/watch?v=Sz6M...
#alvaModel #machinelearning #chemsky
With alvaModel, you can visualize atomic and fragment contributions and, for KNN models, inspect the nearest neighbour compounds used for the prediction.
🎥 Watch the video:
www.youtube.com/watch?v=Sz6M...
#alvaModel #machinelearning #chemsky
alvaModel - Prediction detail
YouTube video by Alvascience
www.youtube.com
June 16, 2026 at 12:29 PM
Prediction Detail go beyond the predicted value.
With alvaModel, you can visualize atomic and fragment contributions and, for KNN models, inspect the nearest neighbour compounds used for the prediction.
🎥 Watch the video:
www.youtube.com/watch?v=Sz6M...
#alvaModel #machinelearning #chemsky
With alvaModel, you can visualize atomic and fragment contributions and, for KNN models, inspect the nearest neighbour compounds used for the prediction.
🎥 Watch the video:
www.youtube.com/watch?v=Sz6M...
#alvaModel #machinelearning #chemsky
Learn how to import external variables and define your target in alvaModel for QSAR/QSPR modeling.
📽️ youtube.com/watch?v=Nb-8...
📘 More on alvaModel: alvascience.com/alvamodel/
#QSAR #QSPR #Cheminformatics #alvaModel #alvascience #chemsky #machinelearning
📽️ youtube.com/watch?v=Nb-8...
📘 More on alvaModel: alvascience.com/alvamodel/
#QSAR #QSPR #Cheminformatics #alvaModel #alvascience #chemsky #machinelearning
alvaModel - Import external variables
YouTube video by Alvascience
youtube.com
June 30, 2025 at 9:38 AM
Learn how to import external variables and define your target in alvaModel for QSAR/QSPR modeling.
📽️ youtube.com/watch?v=Nb-8...
📘 More on alvaModel: alvascience.com/alvamodel/
#QSAR #QSPR #Cheminformatics #alvaModel #alvascience #chemsky #machinelearning
📽️ youtube.com/watch?v=Nb-8...
📘 More on alvaModel: alvascience.com/alvamodel/
#QSAR #QSPR #Cheminformatics #alvaModel #alvascience #chemsky #machinelearning
Interested in QSAR/QSPR modeling?
Check out this short video introducing alvaModel, a tool for building and validating predictive models in cheminformatics.
🎥 www.youtube.com/watch?v=U0J2...
🔗 www.alvascience.com/alvamodel/
#QSAR #QSPR #Cheminformatics #alvaModel #MachineLearning #chemsky
Check out this short video introducing alvaModel, a tool for building and validating predictive models in cheminformatics.
🎥 www.youtube.com/watch?v=U0J2...
🔗 www.alvascience.com/alvamodel/
#QSAR #QSPR #Cheminformatics #alvaModel #MachineLearning #chemsky
alvaModel v2.0 introduction
YouTube video by Alvascience
www.youtube.com
July 23, 2025 at 12:54 PM
Interested in QSAR/QSPR modeling?
Check out this short video introducing alvaModel, a tool for building and validating predictive models in cheminformatics.
🎥 www.youtube.com/watch?v=U0J2...
🔗 www.alvascience.com/alvamodel/
#QSAR #QSPR #Cheminformatics #alvaModel #MachineLearning #chemsky
Check out this short video introducing alvaModel, a tool for building and validating predictive models in cheminformatics.
🎥 www.youtube.com/watch?v=U0J2...
🔗 www.alvascience.com/alvamodel/
#QSAR #QSPR #Cheminformatics #alvaModel #MachineLearning #chemsky
🎥 Introduction video: youtu.be/5TVcpxTdQAY
🔗 More info at: alvascience.com/alvamodel
#QSAR #Cheminformatics #DrugDiscovery #alvaModel #AI4Science #QSPR #MachineLearning
🔗 More info at: alvascience.com/alvamodel
#QSAR #Cheminformatics #DrugDiscovery #alvaModel #AI4Science #QSPR #MachineLearning
alvaModel v3.0 - Introduction
YouTube video by Alvascience
youtu.be
November 4, 2025 at 11:07 AM
🎥 Introduction video: youtu.be/5TVcpxTdQAY
🔗 More info at: alvascience.com/alvamodel
#QSAR #Cheminformatics #DrugDiscovery #alvaModel #AI4Science #QSPR #MachineLearning
🔗 More info at: alvascience.com/alvamodel
#QSAR #Cheminformatics #DrugDiscovery #alvaModel #AI4Science #QSPR #MachineLearning
Analyze QSAR Predictions in alvaModel
Break down predictions with experimental vs. predicted values, applicability domain, atomic & fragment contributions, and KNN neighbors.
📺 Watch: youtube.com/watch?v=Sz6M...
#alvaModel #QSAR #Cheminformatics #PredictiveModeling #Alvascience
Break down predictions with experimental vs. predicted values, applicability domain, atomic & fragment contributions, and KNN neighbors.
📺 Watch: youtube.com/watch?v=Sz6M...
#alvaModel #QSAR #Cheminformatics #PredictiveModeling #Alvascience
alvaModel - Prediction detail
YouTube video by Alvascience
youtube.com
March 21, 2025 at 10:23 AM
Analyze QSAR Predictions in alvaModel
Break down predictions with experimental vs. predicted values, applicability domain, atomic & fragment contributions, and KNN neighbors.
📺 Watch: youtube.com/watch?v=Sz6M...
#alvaModel #QSAR #Cheminformatics #PredictiveModeling #Alvascience
Break down predictions with experimental vs. predicted values, applicability domain, atomic & fragment contributions, and KNN neighbors.
📺 Watch: youtube.com/watch?v=Sz6M...
#alvaModel #QSAR #Cheminformatics #PredictiveModeling #Alvascience
🇯🇵 Webinar: What’s New in alvaModel 3.0
Our Japanese reseller AffinityScience is hosting a webinar on Dec 16 (Tue) to introduce the new features of alvaModel 3.0.
🔗 Details (JP): affinity-science.com/news_2025111...
#alvaModel #QSAR #Cheminformatics #MachineLearning #Alvascience #chemsky #webinar
Our Japanese reseller AffinityScience is hosting a webinar on Dec 16 (Tue) to introduce the new features of alvaModel 3.0.
🔗 Details (JP): affinity-science.com/news_2025111...
#alvaModel #QSAR #Cheminformatics #MachineLearning #Alvascience #chemsky #webinar
November 14, 2025 at 10:40 AM
🇯🇵 Webinar: What’s New in alvaModel 3.0
Our Japanese reseller AffinityScience is hosting a webinar on Dec 16 (Tue) to introduce the new features of alvaModel 3.0.
🔗 Details (JP): affinity-science.com/news_2025111...
#alvaModel #QSAR #Cheminformatics #MachineLearning #Alvascience #chemsky #webinar
Our Japanese reseller AffinityScience is hosting a webinar on Dec 16 (Tue) to introduce the new features of alvaModel 3.0.
🔗 Details (JP): affinity-science.com/news_2025111...
#alvaModel #QSAR #Cheminformatics #MachineLearning #Alvascience #chemsky #webinar
🎥 Optimize KNN Models with alvaModel
Learn how to fine-tune the number of neighbors (K) in a KNN model for better QSAR/QSPR predictions.
📺 Watch now: www.youtube.com/watch?v=h4Do...
📖 More about alvaModel: alvascience.com/alvamodel/
#KNN #MachineLearning #QSAR #Cheminformatics
Learn how to fine-tune the number of neighbors (K) in a KNN model for better QSAR/QSPR predictions.
📺 Watch now: www.youtube.com/watch?v=h4Do...
📖 More about alvaModel: alvascience.com/alvamodel/
#KNN #MachineLearning #QSAR #Cheminformatics
alvaModel - Optimize K
YouTube video by Alvascience
www.youtube.com
February 24, 2025 at 2:04 PM
🎥 Optimize KNN Models with alvaModel
Learn how to fine-tune the number of neighbors (K) in a KNN model for better QSAR/QSPR predictions.
📺 Watch now: www.youtube.com/watch?v=h4Do...
📖 More about alvaModel: alvascience.com/alvamodel/
#KNN #MachineLearning #QSAR #Cheminformatics
Learn how to fine-tune the number of neighbors (K) in a KNN model for better QSAR/QSPR predictions.
📺 Watch now: www.youtube.com/watch?v=h4Do...
📖 More about alvaModel: alvascience.com/alvamodel/
#KNN #MachineLearning #QSAR #Cheminformatics
🇯🇵 Japanese-language online workshop on August 6!
Join Affinity Science for hands-on training with alvaModel and alvaRunner- from building QSAR/QSPR models to applying them to new molecules.
Details: www.affinity-science.com/news_2026070...
#machinelearning #Cheminformatics #QSAR #chemsky
Join Affinity Science for hands-on training with alvaModel and alvaRunner- from building QSAR/QSPR models to applying them to new molecules.
Details: www.affinity-science.com/news_2026070...
#machinelearning #Cheminformatics #QSAR #chemsky
alvaModel/alvaRunnerオンライン講習会（2026年8月）開催のご案内 | 株式会社アフィニティサイエンス
2026年8月開催のalvaModel/alvaRunner講習会のお知らせ
www.affinity-science.com
July 28, 2026 at 9:31 AM
🇯🇵 Japanese-language online workshop on August 6!
Join Affinity Science for hands-on training with alvaModel and alvaRunner- from building QSAR/QSPR models to applying them to new molecules.
Details: www.affinity-science.com/news_2026070...
#machinelearning #Cheminformatics #QSAR #chemsky
Join Affinity Science for hands-on training with alvaModel and alvaRunner- from building QSAR/QSPR models to applying them to new molecules.
Details: www.affinity-science.com/news_2026070...
#machinelearning #Cheminformatics #QSAR #chemsky
🎥 QSAR/QSPR Modeling Webinar
Learn the key steps in QSAR/QSPR modeling, from data curation model deployment using alvaDesc, alvaModel, and alvaRunner.
📺 Watch now: www.youtube.com/watch?v=zHA9...
#QSAR #QSPR #Cheminformatics #MachineLearning #alvaDesc #alvaModel #alvaRunner
Learn the key steps in QSAR/QSPR modeling, from data curation model deployment using alvaDesc, alvaModel, and alvaRunner.
📺 Watch now: www.youtube.com/watch?v=zHA9...
#QSAR #QSPR #Cheminformatics #MachineLearning #alvaDesc #alvaModel #alvaRunner
Alvascience Webinar: QSAR / QSPR models with Alvascience software
YouTube video by Alvascience
www.youtube.com
January 30, 2025 at 2:08 PM
🎥 QSAR/QSPR Modeling Webinar
Learn the key steps in QSAR/QSPR modeling, from data curation model deployment using alvaDesc, alvaModel, and alvaRunner.
📺 Watch now: www.youtube.com/watch?v=zHA9...
#QSAR #QSPR #Cheminformatics #MachineLearning #alvaDesc #alvaModel #alvaRunner
Learn the key steps in QSAR/QSPR modeling, from data curation model deployment using alvaDesc, alvaModel, and alvaRunner.
📺 Watch now: www.youtube.com/watch?v=zHA9...
#QSAR #QSPR #Cheminformatics #MachineLearning #alvaDesc #alvaModel #alvaRunner
📚 Alvascience tools have now been cited in more than 700 scientific publications!
We are proud to see alvaMolecule, alvaDesc, alvaModel, alvaRunner and alvaBuilder supporting research across cheminformatics, QSAR/QSPR modeling, toxicology, drug discovery, materials science.
We are proud to see alvaMolecule, alvaDesc, alvaModel, alvaRunner and alvaBuilder supporting research across cheminformatics, QSAR/QSPR modeling, toxicology, drug discovery, materials science.
May 22, 2026 at 12:41 PM
📚 Alvascience tools have now been cited in more than 700 scientific publications!
We are proud to see alvaMolecule, alvaDesc, alvaModel, alvaRunner and alvaBuilder supporting research across cheminformatics, QSAR/QSPR modeling, toxicology, drug discovery, materials science.
We are proud to see alvaMolecule, alvaDesc, alvaModel, alvaRunner and alvaBuilder supporting research across cheminformatics, QSAR/QSPR modeling, toxicology, drug discovery, materials science.
🎉 Great news for Mac users!
We’re happy to share that all #Alvascience software tools - alvaDesc, alvaModel, alvaBuilder, alvaRunner, and alvaMolecule - are fully compatible with macOS Tahoe.
🔗 Learn more about our tools: alvascience.com
#macOS #Tahoe #software #cheminformatics #chemsky
We’re happy to share that all #Alvascience software tools - alvaDesc, alvaModel, alvaBuilder, alvaRunner, and alvaMolecule - are fully compatible with macOS Tahoe.
🔗 Learn more about our tools: alvascience.com
#macOS #Tahoe #software #cheminformatics #chemsky
November 20, 2025 at 2:19 PM
🎉 Great news for Mac users!
We’re happy to share that all #Alvascience software tools - alvaDesc, alvaModel, alvaBuilder, alvaRunner, and alvaMolecule - are fully compatible with macOS Tahoe.
🔗 Learn more about our tools: alvascience.com
#macOS #Tahoe #software #cheminformatics #chemsky
We’re happy to share that all #Alvascience software tools - alvaDesc, alvaModel, alvaBuilder, alvaRunner, and alvaMolecule - are fully compatible with macOS Tahoe.
🔗 Learn more about our tools: alvascience.com
#macOS #Tahoe #software #cheminformatics #chemsky
New paper using alvaDesc and alvaModel 🧪
A recent QSPR study combined experimental PAMPA measurements with 5,666 descriptors calculated by alvaDesc and models developed with alvaModel to investigate skin permeability and
retention of chalcones.
📄 doi.org/10.17344/acs...
#QSAR #QSPR #chemsky
A recent QSPR study combined experimental PAMPA measurements with 5,666 descriptors calculated by alvaDesc and models developed with alvaModel to investigate skin permeability and
retention of chalcones.
📄 doi.org/10.17344/acs...
#QSAR #QSPR #chemsky
September 9, 2026 at 12:50 PM
New paper using alvaDesc and alvaModel 🧪
A recent QSPR study combined experimental PAMPA measurements with 5,666 descriptors calculated by alvaDesc and models developed with alvaModel to investigate skin permeability and
retention of chalcones.
📄 doi.org/10.17344/acs...
#QSAR #QSPR #chemsky
A recent QSPR study combined experimental PAMPA measurements with 5,666 descriptors calculated by alvaDesc and models developed with alvaModel to investigate skin permeability and
retention of chalcones.
📄 doi.org/10.17344/acs...
#QSAR #QSPR #chemsky
A new Discover Chemistry review surveys machine-learning methods and software for QSAR modelling.
We are pleased to see alvaDesc and alvaModel included among the reviewed tools and our related publications cited.
doi.org/10.1007/s443...
#QSAR #Cheminformatics #alvaDesc #machinelearning
We are pleased to see alvaDesc and alvaModel included among the reviewed tools and our related publications cited.
doi.org/10.1007/s443...
#QSAR #Cheminformatics #alvaDesc #machinelearning
August 17, 2026 at 7:52 AM
A new Discover Chemistry review surveys machine-learning methods and software for QSAR modelling.
We are pleased to see alvaDesc and alvaModel included among the reviewed tools and our related publications cited.
doi.org/10.1007/s443...
#QSAR #Cheminformatics #alvaDesc #machinelearning
We are pleased to see alvaDesc and alvaModel included among the reviewed tools and our related publications cited.
doi.org/10.1007/s443...
#QSAR #Cheminformatics #alvaDesc #machinelearning
Need to share your QSAR models?
🎥 youtube.com/watch?v=UJoJ...
This video shows how to export your models as #alvaRunner projects, making them easy to share and apply to new molecules.
Learn more:
🔗 alvascience.com/alvamodel/
Example alvaRunner projects:
🔗 alvascience.com/model-studies/
#chemsky
🎥 youtube.com/watch?v=UJoJ...
This video shows how to export your models as #alvaRunner projects, making them easy to share and apply to new molecules.
Learn more:
🔗 alvascience.com/alvamodel/
Example alvaRunner projects:
🔗 alvascience.com/model-studies/
#chemsky
alvaModel - Model deployment
YouTube video by Alvascience
youtube.com
July 13, 2026 at 3:25 PM
Need to share your QSAR models?
🎥 youtube.com/watch?v=UJoJ...
This video shows how to export your models as #alvaRunner projects, making them easy to share and apply to new molecules.
Learn more:
🔗 alvascience.com/alvamodel/
Example alvaRunner projects:
🔗 alvascience.com/model-studies/
#chemsky
🎥 youtube.com/watch?v=UJoJ...
This video shows how to export your models as #alvaRunner projects, making them easy to share and apply to new molecules.
Learn more:
🔗 alvascience.com/alvamodel/
Example alvaRunner projects:
🔗 alvascience.com/model-studies/
#chemsky
Prediction Detail is also available in alvaRunner.
🔗 alvaModel: alvascience.com/alvamodel/
🔗 alvaRunner: alvascience.com/alvarunner/
#Alvascience #QSAR #QSPR #Cheminformatics #ExplainableAI #alvaRunner
🔗 alvaModel: alvascience.com/alvamodel/
🔗 alvaRunner: alvascience.com/alvarunner/
#Alvascience #QSAR #QSPR #Cheminformatics #ExplainableAI #alvaRunner
June 16, 2026 at 12:29 PM
Prediction Detail is also available in alvaRunner.
🔗 alvaModel: alvascience.com/alvamodel/
🔗 alvaRunner: alvascience.com/alvarunner/
#Alvascience #QSAR #QSPR #Cheminformatics #ExplainableAI #alvaRunner
🔗 alvaModel: alvascience.com/alvamodel/
🔗 alvaRunner: alvascience.com/alvarunner/
#Alvascience #QSAR #QSPR #Cheminformatics #ExplainableAI #alvaRunner
🔹 #alvaMolecule
🔹 #alvaDesc
🔹 #alvaModel / #alvaRunner
🔹 #alvaBuilder
Participation is free.
Details & registration ↓
www.affinity-science.com/news_2026043...
#Alvascience #Cheminformatics #QSAR #MolecularModeling #DrugDiscovery #InSilico #chemsky
🔹 #alvaDesc
🔹 #alvaModel / #alvaRunner
🔹 #alvaBuilder
Participation is free.
Details & registration ↓
www.affinity-science.com/news_2026043...
#Alvascience #Cheminformatics #QSAR #MolecularModeling #DrugDiscovery #InSilico #chemsky
Alvascience社ソフトウェアスイート紹介ウェビナー(2026年) 開催のご案内 | 株式会社アフィニティサイエンス
時下ますますご清栄のこととお慶び申し上げます。日頃は、弊社取り扱い製品・サービスをご愛顧いただき誠にありがとうございます。 さて、この度、分子記述子の計算や、QSAR/QSPRモデルの作成、de novo分子生成などに関心がある方を対象に、Alvascience社ソフトウェアスイート全体の概要についてご説明するウェビナーを6月2日（火）に開催致します。 本ウェビナーが皆様のAlvascience社...
www.affinity-science.com
May 21, 2026 at 2:01 PM
🔹 #alvaMolecule
🔹 #alvaDesc
🔹 #alvaModel / #alvaRunner
🔹 #alvaBuilder
Participation is free.
Details & registration ↓
www.affinity-science.com/news_2026043...
#Alvascience #Cheminformatics #QSAR #MolecularModeling #DrugDiscovery #InSilico #chemsky
🔹 #alvaDesc
🔹 #alvaModel / #alvaRunner
🔹 #alvaBuilder
Participation is free.
Details & registration ↓
www.affinity-science.com/news_2026043...
#Alvascience #Cheminformatics #QSAR #MolecularModeling #DrugDiscovery #InSilico #chemsky
📊 How to analyse a model using charts in alvaModel
Learn how to use Williams plots, residual charts, and other visual tools in alvaModel to better evaluate #QSAR and #QSPR models.
🎥 Watch now: youtube.com/watch?v=xRKK...
🌐 More on #alvaModel: alvascience.com/alvamodel/
#MachineLearning #chemsky
Learn how to use Williams plots, residual charts, and other visual tools in alvaModel to better evaluate #QSAR and #QSPR models.
🎥 Watch now: youtube.com/watch?v=xRKK...
🌐 More on #alvaModel: alvascience.com/alvamodel/
#MachineLearning #chemsky
alvaModel - Charts
YouTube video by Alvascience
youtube.com
May 18, 2026 at 12:36 PM
📊 How to analyse a model using charts in alvaModel
Learn how to use Williams plots, residual charts, and other visual tools in alvaModel to better evaluate #QSAR and #QSPR models.
🎥 Watch now: youtube.com/watch?v=xRKK...
🌐 More on #alvaModel: alvascience.com/alvamodel/
#MachineLearning #chemsky
Learn how to use Williams plots, residual charts, and other visual tools in alvaModel to better evaluate #QSAR and #QSPR models.
🎥 Watch now: youtube.com/watch?v=xRKK...
🌐 More on #alvaModel: alvascience.com/alvamodel/
#MachineLearning #chemsky
🧪 Screen Before You Synthesize
Automate toxicity screening to identify hazardous compounds before synthesis.
Explore Alvascience tools for descriptors, QSAR modeling and predictive workflows:
🔹 alvaMolecule
🔹 alvaDesc
🔹 alvaModel
🔹 alvaRunner
More info at: alvascience.com
#QSAR #GreenChemistry
Automate toxicity screening to identify hazardous compounds before synthesis.
Explore Alvascience tools for descriptors, QSAR modeling and predictive workflows:
🔹 alvaMolecule
🔹 alvaDesc
🔹 alvaModel
🔹 alvaRunner
More info at: alvascience.com
#QSAR #GreenChemistry
May 13, 2026 at 1:09 PM
🧪 Screen Before You Synthesize
Automate toxicity screening to identify hazardous compounds before synthesis.
Explore Alvascience tools for descriptors, QSAR modeling and predictive workflows:
🔹 alvaMolecule
🔹 alvaDesc
🔹 alvaModel
🔹 alvaRunner
More info at: alvascience.com
#QSAR #GreenChemistry
Automate toxicity screening to identify hazardous compounds before synthesis.
Explore Alvascience tools for descriptors, QSAR modeling and predictive workflows:
🔹 alvaMolecule
🔹 alvaDesc
🔹 alvaModel
🔹 alvaRunner
More info at: alvascience.com
#QSAR #GreenChemistry
🎥 Want to improve your KNN models?
Choosing the right number of neighbors (k) is critical for model performance, too small can overfit, too large can reduce accuracy.
youtube.com/watch?v=h4Do...
#MachineLearning #KNN #QSAR #QSPR #alvaModel #Alvascience #chemsky
Choosing the right number of neighbors (k) is critical for model performance, too small can overfit, too large can reduce accuracy.
youtube.com/watch?v=h4Do...
#MachineLearning #KNN #QSAR #QSPR #alvaModel #Alvascience #chemsky
alvaModel - Optimize K
YouTube video by Alvascience
youtube.com
May 4, 2026 at 8:39 AM
🎥 Want to improve your KNN models?
Choosing the right number of neighbors (k) is critical for model performance, too small can overfit, too large can reduce accuracy.
youtube.com/watch?v=h4Do...
#MachineLearning #KNN #QSAR #QSPR #alvaModel #Alvascience #chemsky
Choosing the right number of neighbors (k) is critical for model performance, too small can overfit, too large can reduce accuracy.
youtube.com/watch?v=h4Do...
#MachineLearning #KNN #QSAR #QSPR #alvaModel #Alvascience #chemsky
How to define the applicability domain (AD) in your models?
This video shows how to add and evaluate #AD in #alvaModel, helping ensure reliable predictions.
🎥 Video: youtube.com/watch?v=jnQl...
🔗 More on alvaModel: alvascience.com/alvamodel/
#Alvascience #alvaModel #QSAR #QSPR #chemsky
This video shows how to add and evaluate #AD in #alvaModel, helping ensure reliable predictions.
🎥 Video: youtube.com/watch?v=jnQl...
🔗 More on alvaModel: alvascience.com/alvamodel/
#Alvascience #alvaModel #QSAR #QSPR #chemsky
alvaModel - Applicability Domain
YouTube video by Alvascience
youtube.com
April 17, 2026 at 9:21 AM
How to define the applicability domain (AD) in your models?
This video shows how to add and evaluate #AD in #alvaModel, helping ensure reliable predictions.
🎥 Video: youtube.com/watch?v=jnQl...
🔗 More on alvaModel: alvascience.com/alvamodel/
#Alvascience #alvaModel #QSAR #QSPR #chemsky
This video shows how to add and evaluate #AD in #alvaModel, helping ensure reliable predictions.
🎥 Video: youtube.com/watch?v=jnQl...
🔗 More on alvaModel: alvascience.com/alvamodel/
#Alvascience #alvaModel #QSAR #QSPR #chemsky
New study using #alvaDesc & #alvaModel to predict polyurethane melting temperature (Tm) via #QSPR
5,600+ descriptors tested; PLS delivered the best performance, supporting fast, cost-effective polymer design.
📖 doi.org/10.1007/s424...
🔗 alvascience.com/alvadesc/
#Polymers #cheminformatics #chemsky
5,600+ descriptors tested; PLS delivered the best performance, supporting fast, cost-effective polymer design.
📖 doi.org/10.1007/s424...
🔗 alvascience.com/alvadesc/
#Polymers #cheminformatics #chemsky
Molecular Descriptors-Based Analysis for Computation of Polyurethane Melting Temperature - Multiscale Science and Engineering
Multiscale Science and Engineering - Polyurethane (PU) is a highly popular polymer used in several industrial spheres, the thermal and mechanical functioning of which is determined most important...
doi.org
February 19, 2026 at 4:34 PM
New study using #alvaDesc & #alvaModel to predict polyurethane melting temperature (Tm) via #QSPR
5,600+ descriptors tested; PLS delivered the best performance, supporting fast, cost-effective polymer design.
📖 doi.org/10.1007/s424...
🔗 alvascience.com/alvadesc/
#Polymers #cheminformatics #chemsky
5,600+ descriptors tested; PLS delivered the best performance, supporting fast, cost-effective polymer design.
📖 doi.org/10.1007/s424...
🔗 alvascience.com/alvadesc/
#Polymers #cheminformatics #chemsky
Biomimetic LC×LC + Permeapad® combined with QSAR modeling to study transdermal drug diffusion 🧪
Neri et al. integrate experimental skin-mimicking chromatography with #alvaDesc and #alvaModel to predict log Kp in a high-throughput, animal-free way.
Neri et al. integrate experimental skin-mimicking chromatography with #alvaDesc and #alvaModel to predict log Kp in a high-throughput, animal-free way.
January 27, 2026 at 2:32 PM
Biomimetic LC×LC + Permeapad® combined with QSAR modeling to study transdermal drug diffusion 🧪
Neri et al. integrate experimental skin-mimicking chromatography with #alvaDesc and #alvaModel to predict log Kp in a high-throughput, animal-free way.
Neri et al. integrate experimental skin-mimicking chromatography with #alvaDesc and #alvaModel to predict log Kp in a high-throughput, animal-free way.
📊 Dataset comparison in alvaModel
A short video showing how to compare training/test datasets using box plots and stacked bars to spot distribution shifts and class imbalance, before building QSAR/QSPR models.
🎥 www.youtube.com/watch?v=EMSt...
#QSAR #QSPR #Cheminformatics #alvaModel #chemsky
A short video showing how to compare training/test datasets using box plots and stacked bars to spot distribution shifts and class imbalance, before building QSAR/QSPR models.
🎥 www.youtube.com/watch?v=EMSt...
#QSAR #QSPR #Cheminformatics #alvaModel #chemsky
alvaModel - Dataset comparison
YouTube video by Alvascience
www.youtube.com
January 15, 2026 at 3:46 PM
📊 Dataset comparison in alvaModel
A short video showing how to compare training/test datasets using box plots and stacked bars to spot distribution shifts and class imbalance, before building QSAR/QSPR models.
🎥 www.youtube.com/watch?v=EMSt...
#QSAR #QSPR #Cheminformatics #alvaModel #chemsky
A short video showing how to compare training/test datasets using box plots and stacked bars to spot distribution shifts and class imbalance, before building QSAR/QSPR models.
🎥 www.youtube.com/watch?v=EMSt...
#QSAR #QSPR #Cheminformatics #alvaModel #chemsky
Happy holidays from all of us at Alvascience!
Thank you for your continued support throughout the year, we look forward to new ideas, collaborations, and discoveries in the next year.
#alvaMolecule #alvaDesc #alvaModel #alvaRunner #alvaBuilder #alvaQSAR #chemsky
Thank you for your continued support throughout the year, we look forward to new ideas, collaborations, and discoveries in the next year.
#alvaMolecule #alvaDesc #alvaModel #alvaRunner #alvaBuilder #alvaQSAR #chemsky
December 24, 2025 at 9:28 AM
Happy holidays from all of us at Alvascience!
Thank you for your continued support throughout the year, we look forward to new ideas, collaborations, and discoveries in the next year.
#alvaMolecule #alvaDesc #alvaModel #alvaRunner #alvaBuilder #alvaQSAR #chemsky
Thank you for your continued support throughout the year, we look forward to new ideas, collaborations, and discoveries in the next year.
#alvaMolecule #alvaDesc #alvaModel #alvaRunner #alvaBuilder #alvaQSAR #chemsky