by Valinor Discovery
Multi-modal virtual patient modeling for predicting therapeutic efficacy before clinical trials.
Computational Drug Safety & PKPD Modeling
by ACD/Labs
Predict physicochemical, ADME/Tox, and molecular properties from structure with trainable models and centralized data management.
Computational Drug Safety & PKPD Modelingby ACD/Labs
Structure-based prediction of absorption, distribution, metabolism, and excretion properties for drug discovery and high-throughput screening.
Computational Drug Safety & PKPD Modelingby ACD/Labs
Structure-based prediction of toxicity endpoints including acute toxicity, mutagenicity, hERG inhibition, and irritation for early-stage drug screening.
Computational Drug Safety & PKPD Modelingby ACD/Labs
Predict Abraham solvation parameters and partition coefficients directly from chemical structure.
Computational Drug Safety & PKPD Modelingby ACD/Labs
Predict genotoxic and carcinogenic potential of pharmaceutical impurities and degradants to meet ICH M7(R2) guidelines.
Computational Drug Safety & PKPD Modeling
by Curi Bio
High-throughput video analysis of contractility and calcium dynamics in 2D and 3D engineered tissues.
Computational Drug Safety & PKPD Modeling
by Ypso-Facto
Chromatography process development and simulation for biologics downstream processing, with mechanistic modeling and buffer preparation tools.
Computational Drug Safety & PKPD Modeling
by Berkeley Madonna
Differential equations solver with graphical interface for constructing and visualizing complex mathematical models.
Computational Drug Safety & PKPD Modeling
by FQS Poland
Skin-body pharmacokinetic simulation for transdermal and topical drug delivery design and optimization.
Computational Drug Safety & PKPD Modeling
by The Epsilon Group
In-silico simulation of Type 1 Diabetes treatment protocols across FDA-accepted patient populations for preclinical testing and insulin dosing algorithm development.
Computational Drug Safety & PKPD Modelingby The Epsilon Group
In silico modeling and simulation of diabetes treatments, devices, and dosing algorithms across virtual patient populations.
Computational Drug Safety & PKPD Modelingby The Epsilon Group
Glucose response simulation for Type 1, Type 2, and prediabetes education across diet, exercise, and medication adjustments.
Computational Drug Safety & PKPD Modeling
by Open Systems Pharmacology
PBPK and quantitative systems pharmacology modeling and simulation for drug development, regulatory submissions, and research.
Computational Drug Safety & PKPD Modeling
by MathWorks
Modeling and simulation for quantitative systems pharmacology, PBPK, and PK/PD applications with parameter estimation and sensitivity analysis.
Computational Drug Safety & PKPD Modeling
by Metrum Research Group
Cloud-native modeling and simulation for model-informed drug development, with GxP validation and support for NONMEM, R, Stan, and other pharmacometric tools.
Computational Drug Safety & PKPD Modeling
by VeriSIM Life
Predictive drug design and development engine using hybrid AI to identify promising candidates and reduce time to IND by 2.5 years.
Computational Drug Safety & PKPD Modeling
by SAS
Discrete event simulation for clinical trial enrollment planning and projections.
Computational Drug Safety & PKPD Modeling