drug-discoveryAI Drug Discovery
AI Drug Discovery · Molecular Design

Chemistry42

By Insilico Medicine

Commercial AI-assisted small-molecule design

Commercial AI-assisted small-molecule design. Supplier performance claims are not independently reproduced; access and deployment require agreement.

Commercial AI-assisted small-molecule designInput: Project chemistry data and design objectivesOutput: Proposed molecular candidates and prioritization
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Overview

Commercial AI-assisted small-molecule design. Supplier performance claims are not independently reproduced; access and deployment require agreement.

Information checked against an official source; not a hands-on test. Source · Last reviewed: 16/09/2026, 17:33:40

Key Features

  • Commercial AI-assisted small-molecule design
  • Input: Project chemistry data and design objectives
  • Output: Proposed molecular candidates and prioritization
Interactive 3D Structure

Chemistry42 Predicted Complex

Streams real 3D atomic coordinates from RCSB Protein Data Bank
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pLDDT / B-Factor:
>90 Very high 70-90 Confident 50-70 Low <50 Very low

Academic Context & Research Evidence

Biological & Workflow Fit

Compute & Hardware
Confirm deployment and system requirements with provider
Licensing & Academic Use
Review the linked release, model weights, datasets and service terms separately
Documented Evidence
Project or provider documentation; no local performance benchmark

Cite this Tool

Use this citation format when referencing Chemistry42 in scientific publications and benchmark papers.

@software{chemistry42_2026,
  title = {{Chemistry42}},
  author = {{Insilico Medicine}},
  year = {2026},
  url = {https://insilico.com/chemistry42_fr},
  note = {Indexed on aibioatlas - AI for Biology and Drug Discovery}
}

Peer-Reviewed Literature & Preprints

Live scientific citations streamed from Europe PMC and PubMed for Chemistry42.

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Technical / Product Information

Missing values mean the catalog has no recorded information. They do not mean a feature is absent.

Entry typeCommercial research software
Access modeProvider account / licence
AI roleScientific machine learning
Input dataProject chemistry data and design objectives
Output dataProposed molecular candidates and prioritization
Licence conditionsReview the linked release, model weights, datasets and service terms separately
Commercial eligibilityNot independently confirmed
Compute requirementsConfirm deployment and system requirements with provider
ValidationEvaluate on representative data; no clinical suitability established
TypeNot recorded
Intended useBiological and pharmaceutical research
CompatibilityNot recorded
LimitationsSupplier performance claims are not independently reproduced; access and deployment require agreement.
Evidence levelProject or provider documentation; no local performance benchmark
AvailabilityProvider access and terms required
Price / accessContact provider for current pricing

Research fit & compatibility

No software–hardware integration has been verified for this entry yet. Explore documented research workflows.

BEFORE YOU CHOOSE

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FAQ

Where is this product available?

Provider access and terms required

How is pricing handled?

Prices reflect the source at its last check. Confirm current pricing and regional availability on the official site.

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Peer Reviews & Community Ratings

Feedback from researchers and computational biologists evaluating Chemistry42.

5.0
★★★★★Based on 0 researcher evaluations
Biological Accuracy
4.8/5
Ease of Installation
4.3/5
Documentation & Code
4.6/5