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Computational Drug Safety & PKPD Modeling
Showing 78 results
QIP-ADMET logo
QIP-ADMET

by Standigm

ADMET prediction for drug discovery using quantum-informed AI models trained on experimental and in silico data.

Computational Drug Safety & PKPD Modeling
In Silico Toxicology & Safety Prediction
Leadscope Model Applier logo
Leadscope Model Applier

by Instem

In silico toxicity predictions with 100+ FDA-collaborated models for pharmaceutical safety, impurity assessment, and regulatory compliance.

Computational Drug Safety & PKPD Modeling
In Silico Toxicology & Safety Prediction
Advance logo
Advance

by Instem

Weight of Evidence assessment for carcinogenicity risk using six integrated modules aligned with ICH S1B guidelines.

Computational Drug Safety & PKPD Modeling
In Silico Toxicology & Safety Prediction
Predict logo
Predict

by Instem

In silico toxicology assessment leveraging computational models and 600,000+ studies for chemical safety evaluation.

Computational Drug Safety & PKPD Modeling
In Silico Toxicology & Safety Prediction
Centrus logo
Centrus

by Instem

Early toxicology risk assessment and safety prediction for drug development using integrated preclinical and clinical data.

Computational Drug Safety & PKPD Modeling
In Silico Toxicology & Safety Prediction
Phoenix logo
Phoenix

by Certara

PK/PD analysis and modeling for non-compartmental analysis, population PK, IVIVC, and toxicokinetic studies.

Computational Drug Safety & PKPD Modeling
Physiologically-Based PK Modeling (PBPK) & Systems Pharmacology
Certara IQ logo
Certara IQ

by Certara

Quantitative systems pharmacology modeling with AI to integrate biological and pharmacological insights for drug efficacy and safety predictions.

Computational Drug Safety & PKPD Modeling
Physiologically-Based PK Modeling (PBPK) & Systems Pharmacology
Simcyp logo
Simcyp

by Certara

PBPK modeling and simulation for predicting drug behavior in diverse populations.

Computational Drug Safety & PKPD Modeling
Physiologically-Based PK Modeling (PBPK) & Systems Pharmacology
GastroPlus logo
GastroPlus

by Simulations Plus

PBPK and biopharmaceutics modeling and simulation for predicting drug absorption, bioavailability, and pharmacokinetics across multiple dosage routes.

Computational Drug Safety & PKPD Modeling
Physiologically-Based PK Modeling (PBPK) & Systems Pharmacology
MonolixSuite logo
MonolixSuite

by Simulations Plus

Population PK/PD modeling, non-compartmental analysis, and simulation for pharmacometrics and model-informed drug development.

Computational Drug Safety & PKPD Modeling
Physiologically-Based PK Modeling (PBPK) & Systems Pharmacology
ADMET Predictor logo
ADMET Predictor

by Simulations Plus

AI/ML prediction of 175+ ADMET and pharmacokinetic properties, including metabolism, toxicity, and solubility, with integrated PBPK simulation and AI-driven drug design.

Computational Drug Safety & PKPD Modeling
In Silico Toxicology & Safety Prediction
DILIsym logo
DILIsym

by Simulations Plus

Quantitative systems toxicology modeling for predicting drug-induced liver injury and mechanistic insight into DILI responses across species.

Computational Drug Safety & PKPD Modeling
In Silico Toxicology & Safety Prediction
Thales logo
Thales

by Simulations Plus

Quantitative systems pharmacology modeling, SimPops® optimization, and clinical simulation for drug development and trial design.

Computational Drug Safety & PKPD Modeling
Physiologically-Based PK Modeling (PBPK) & Systems Pharmacology
NAFLDsym logo
NAFLDsym

by Simulations Plus

Computational modeling of metabolic dysfunction-associated steatotic liver disease to predict treatment efficacy for MASLD and MASH therapies.

Computational Drug Safety & PKPD Modeling
Physiologically-Based PK Modeling (PBPK) & Systems Pharmacology
RENAsym logo
RENAsym

by Simulations Plus

Mechanistic modeling to predict drug-induced kidney injury risk and understand renal safety mechanisms for safer drug design.

Computational Drug Safety & PKPD Modeling
In Silico Toxicology & Safety Prediction
IPFsym logo
IPFsym

by Simulations Plus

Mechanistic QSP modeling for idiopathic pulmonary fibrosis drug development, efficacy prediction, and clinical trial optimization.

Computational Drug Safety & PKPD Modeling
Physiologically-Based PK Modeling (PBPK) & Systems Pharmacology
OBESITYsym logo
OBESITYsym

by Simulations Plus

Quantitative systems pharmacology modeling to predict weight loss efficacy and nausea side effects for obesity therapies.

Computational Drug Safety & PKPD Modeling
Physiologically-Based PK Modeling (PBPK) & Systems Pharmacology
TrialKey logo
TrialKey

by TrialKey

AI-driven biostatistical validation and predictive modeling for optimizing clinical trial design and outcomes.

Computational Drug Safety & PKPD Modeling
Clinical Trial Simulation & Forecasting
OFF-X Translational Safety Intelligence logo
OFF-X Translational Safety Intelligence

by Clarivate Plc

Integrated preclinical and clinical safety data intelligence for anticipating drug toxicity risks and competitive advantage.

Computational Drug Safety & PKPD Modeling
In Silico Toxicology & Safety Prediction
Integrated Evidence logo
Integrated Evidence

by Medidata

Regulatory-grade patient-level data, AI-driven modeling, and synthetic control arms for safer protocols and more efficient clinical development.

Computational Drug Safety & PKPD Modeling
Clinical Trial Simulation & Forecasting