dockerfile.run

nwchem

High-performance computational chemistry software

Debian

RUN apt-get update && \
    apt-get install -y nwchem

Ubuntu

RUN apt-get update && \
    apt-get install -y nwchem

Kali Linux

RUN apt-get update && \
    apt-get install -y nwchem

Fedora

RUN dnf install -y nwchem

Raspbian

RUN apt-get update && \
    apt-get install -y nwchem

click the source code to copy install nwchem on any operating system with command-not-found.com