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Volkamerlab.org lookup results from http://whois.name.com server:
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Host Informations
| Host name | ec2-35-169-59-174.compute-1.amazonaws.com |
| IP address | 35.169.59.174 |
| Location | Ashburn United States |
| Latitude | 39.0481 |
| Longitude | -77.4728 |
| Metro Code | 511 |
| Timezone | America/New_York |
| Postal | 20149 |
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Site Inspections
Websites Listing
We found Websites Listing below when search with volkamerlab.org on Search Engine
GitHub - volkamerlab/volkamerlab_org: Hugo website for …
Volkamerlab.org. Contents for this website, built with Hugo, a static site generator, and deployed to netlify.com. This website is based on the HTML5 Editorial template. Request changes. Fork and create a branch on your fork. Install hugo from package file on GitHub .
Github.comDA: 10 PA: 28 MOZ Rank: 38
TeachOpenCADD 0 documentation - Volkamer Lab
While documentation for such tools is available, only few freely accessible examples teach underlying concepts focused on CADD applications, addressing especially users new to the field. TeachOpenCADD is a teaching platform developed by students for students, which provides teaching material for central CADD topics.
Projects.volkamerlab.orgDA: 24 PA: 15 MOZ Rank: 40
Volkamer Lab · GitHub
Volkamerlab_org Public Hugo website for volkamerlab.org CSS 5 6 10 (1 issue needs help) 0 Updated May 9, 2022. kissim_app Public Kinome-wide structural pocket similarity Jupyter Notebook 7 MIT 1 3 0 Updated Apr 24, 2022. kissim Public Subpocket-based fingerprint for kinase pocket comparison Python 16 MIT 3 4 0 Updated Apr 17, 2022. opencadd Public A Python …
Github.comDA: 10 PA: 12 MOZ Rank: 24
Installing — TeachOpenCADD 0 documentation - Volkamer Lab
Install from the conda package: Create a new conda environment for TeachOpenCADD:, Activate the new environment:, Run teachopencadd -h to test that it works., Run teachopencadd start . to set up a new workspace.. Install from the latest development snapshot: Create a new conda environment and act...
Projects.volkamerlab.orgDA: 24 PA: 30 MOZ Rank: 57
volkamerlab.org Webrate website statistics and online tools
Volkamerlab.org traffic volume is 1,896 unique daily visitors and their 3,792 pageviews. The web value rate of volkamerlab.org is 2,825 USD. Each visitor makes around 2.14 page views on average. Volkamerlab.org belongs to DIGITALOCEAN-ASN - DigitalOcean, LLC, US. Check the list of other websites hosted by DIGITALOCEAN-ASN - DigitalOcean, …
Webrate.orgDA: 11 PA: 32 MOZ Rank: 47
volkamerlab_org | #Static Site Generator | Hugo website for …
Volkamerlab_org has a low active ecosystem. It has 5 star(s) with 6 fork(s). It had no major release in the last 12 months. On average issues are closed in 47 days. It has a neutral sentiment in the developer community.
Kandi.openweaver.comDA: 20 PA: 32 MOZ Rank: 57
volkamerlab (Volkamerlab) – KNIME Hub
Volkamerlab Joined 3 years ago. 0. placeholder. 0. Workflows published. 0. Components published. 0. Extensions published. 0. Likes received. volkamerlab’s liked items. volkamerlab did not like any items yet. KNIME Open for Innovation KNIME AG Hardturmstrasse 66 8005 Zurich, Switzerland Software; Getting started; Documentation; E-Learning course ; Solutions; …
Hub.knime.comDA: 13 PA: 12 MOZ Rank: 31
Google Colab
1. Aims of this session. This session will serve as a programming tutorial following the previous theoretical session on machine learning. We will revisit the basic concepts of machine learning using a practical example. We will use the Python programming language and learn to use Python's machine learning package 'scikit-learn' (along with pandas, numpy and matplotlib …
Colab.research.google.comDA: 25 PA: 50 MOZ Rank: 43
#VolkamerLab hashtag on Twitter
See Tweets about #VolkamerLab on Twitter. See what people are saying and join the conversation.
Twitter.comDA: 11 PA: 20 MOZ Rank: 39
volkamerlab/Public – data – KNIME Hub
Volkamerlab Spaces Public TeachOpenCADD_Workflow1_Data_acquisition_ChEMBL data Public space. Public. Last edited: 3 Like. Copy short link. Home TeachOpenCADD_Workflow1_Data_acquisition_ChEMBL data Type Name Go to parent workflow group W1_query_results_20210125.table ...
Hub.knime.comDA: 13 PA: 50 MOZ Rank: 41
Andrea Volkamer's lab | Charité Universitätsmedizin Berlin (Charité)
Principal Investigator: Andrea Volkamer | ResearchGate, the professional network for scientists
Researchgate.netDA: 20 PA: 24 MOZ Rank: 54
volkamerlab/KinFragLib: Release v1.1.0 | Zenodo
New release of repository containing data and notebooks for the publication KinFragLib: Exploring the Kinase Inhibitor Space Using Subpocket-Focused Fragmentation and Recombination. New Added GitHub Actions CI running all notebooks with pytest (combinatorial dataset is downloaded from zenodo) Made the former notebooks/utils.py script pip-installable …
Zenodo.orgDA: 10 PA: 15 MOZ Rank: 36
ChemBioSim Recalibration: Twelve Preprocessed ChEMBL Data …
The uploaded file contains the ChEMBL data used in the work for the manuscript “Studying and mitigating the effects of data drifts on ML model performance at the example of chemical toxicity data”. Twelve preprocessed datasets containing molecule chembl ID, SMILES, binary activity (i.e. 1 if active, 0 if inactive), publication year, and ...
Zenodo.orgDA: 10 PA: 15 MOZ Rank: 37
TeachOpenCADD-KNIME体験記 はじめます｜ナイメスト｜note
TeachOpenCADD-KNIME体験記 はじめます. 最初にDominique SydowさんをはじめとしたVolkamer研究所の方々が、どういった目的でTeachOpenCADDのKNIME workflow (WF)を公開されたか、紹介するところから始めます。. research that can be easily transferred to other projects. Setting up, understanding, and ...
Note.comDA: 8 PA: 33 MOZ Rank: 54
Installing — kissim documentation
Install from the conda package . Create a new conda environment called kissim with the kissim package and all its dependencies installed: mamba create -n kissim kissim. Activate the new conda environment: conda activate kissim. Test that your installation works: kissim -h.
Kissim.readthedocs.ioDA: 21 PA: 26 MOZ Rank: 61
GitHub: volkamerlab/TeachOpenCADD/master - Binder
Click to run this interactive environment. From the Binder Project: Reproducible, sharable, interactive computing environments.
Mybinder.orgDA: 12 PA: 39 MOZ Rank: 66
Deep Learning in Virtual Screening: Recent Applications and ...
Herein, recent applications and developments of machine learning, with a focus on deep learning, in virtual screening for active compound design are reviewed. This includes introducing different compound and protein encodings, deep learning techniques as well as frequently used bioactivity and benchmark data sets for model training and testing ...
Ncbi.nlm.nih.govDA: 20 PA: 25 MOZ Rank: 61
Supporting Information: KinFragLib: Exploring the Kinase Inhibitor ...
Supporting Information: KinFragLib: Exploring the Kinase Inhibitor Space Using Subpocket-Focused Fragmentation and Recombination Dominique Sydow, y,{Paula Schmiel, Jérémie Mortier,zand Andrea Volkamer,y yIn Silico Toxicology and Structural Bioinformatics, Institute of Physiology, Charité -
Chemrxiv.orgDA: 12 PA: 50 MOZ Rank: 33
Andrea VOLKAMER | Professor | Charité Universitätsmedizin Berlin ...
Andrea VOLKAMER | Cited by 1,278 | of Charité Universitätsmedizin Berlin, Berlin (Charité) | Read 53 publications | Contact Andrea VOLKAMER
Researchgate.netDA: 20 PA: 26 MOZ Rank: 64
Assessing the calibration in toxicological in vitro models with ...
Data preprocessing . The datasets were standardised as described in Morger et al. [].Briefly, the IMI eTox standardiser tool was applied to discard non-organic compounds, to exert certain structure standardisation rules, to neutralise, and to remove salts [].Before and after applying the standardisation protocol, compounds with duplicate InChIs (IUPAC International …
Ncbi.nlm.nih.govDA: 20 PA: 25 MOZ Rank: 64
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