1 тысяч подписчиков
33 видео
Datawarrior tutorial
DataWarrior: Advanced data visualisation and macros
PK Solver - a free tool to analyse pharmacokinetic data and derive PK parameters
Free Drug Discovery Databases and R-group analysis with DataWarrior 2016 09 08
Using Knime in compound design and analysis 2016 04 21
Using Jupyter as an electronic notebook to store and share computational chemistry
Tylosin analogs as antifilarials: Tom von Geldern
PDBe Abhik Mukhopadhyay
Structure-Based Virtual Screening on the cheap – Prof. David Koes, University of Pittsburgh
StarDrop Core/ADME QSAR module Training Session 2019
ChimeraX features for the visualisation and analysis of ligand/protein complexes.
Selecting ADMET models for Drug Discovery
Free PK modelling tool Part II
Launch of Malaria Inhibitor Prediction platform (
Antimalarial and Anti Wolbachia drug discovery using cheminformatics and machine learning
In Silico models what to do, what not to do
2017 02 15 15 01 Transforming ‘hits’ into ‘leads’ Two malaria drug discovery case studies
SwissDrugDesign a free web based environment for docking, virtual screening, target prediction and
PKTool3 0 launch
Heterocyclic Quinolones – privileged pharmacophore for TB and Malaria
SwissADME a web tool to support pharmacokinetic optimization for drug discovery
Processing malaria HTS results using KNIME: a tutorial
Predicting physicochemical properties with OCHEM and using chemistry in patents
Tools and techniques in small-molecule structure-based drug discovery - Prof. Jacob Durrant, U Pitt
Hit triaging and advancement to Anti-Wolbachial lead compounds
Martine Keenan (Epichem) The Role of Cyp51 inhibitors in Chagas disease research
PKTool v2.0 - update of popular free tool for dose prediction and pharmacokinetic modelling
