---
title: "Computational Chemist at Topos Bio – San Francisco, CA"
canonical: "https://www.metaintro.com/job/computational-chemist-at-topos-bio-778cafe0-c8ad-5851-b9b4-e4055e9fd001"
language: "en"
author: "Metaintro"
---

[![Topos Bio logo](/api/company-logo?url=https%3A%2F%2Fwww.toposbio.ai%2Fapple-touch-icon.png&sig=dDwPsEQHkJys7O8_wl_jS8q3KLUqZP3fXY3IYxt5wzs)](/company/topos-bio)[Topos Bio](/company/topos-bio)
# Computational Chemist at Topos Bio

Department: Engineering

**Setup**
: On-site

**Location**
: San Francisco, California

**Type**
: Full-time

**Level**
: senior

**Posted**
: Sep 30, 2026

## Description

Topos Bio is seeking a Computational Chemist to generate novel molecules for drug-discovery targets and collaborate with AI researchers and experimental scientists. The role involves developing scalable workflows and data pipelines, running molecular dynamics simulations with enhanced sampling, building cheminformatics pipelines, integrating simulation data into machine-learning models, and communicating computational approaches to scientific and business audiences. The position requires a relevant PhD, experience with molecular modeling, simulation, and generative drug design, proficiency with computational biophysics and cheminformatics tools, expert coding, and familiarity with HPC, cloud computing, containerization, and workflow orchestration.

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