1
Understanding molecular simulation : from algorithms to applications /
Book
Subject (ZB): ...computer simulation...
Table of Contents 
2
NIC Symposium 2022 : 29 - 30 September 2022, Jülich, Germany ; proceedings /
Book
Subject (ZB): ...high performance computing...
Table of Contents 
3
Atomic-scale modelling of electrochemical systems /
Book
Subject (ZB): ...computational chemistry...
Table of Contents 
4
Data science in chemistry : artificial intelligence, big data, chemometrics and quantum computing with Jupyter /
Book
Subject (ZB): ...quantum computing, quantum computer...
Table of Contents 
5
Computational methods in organometallic catalysis : from elementary reactions to mechanisms /
Book
Lan, Yu
2021
Subject (ZB): ...computational chemistry...
Table of Contents 
6
Computational chemistry methods : applications /
Book
Subject (ZB): ...computational chemistry...
Table of Contents 
7
Chemical reactions : basic theory and computing /
Book
Subject (ZB): ...computational chemistry...
Table of Contents 
8
Chemical modelling. Volume 14 [E-Book] /
Subject (ZB): ...computational chemistry...

Full text 
9
Mathematical processing of spectral data in analytical chemistry : a guide to error analysis /
Book
Subject (ZB): ...computer application...
Table of Contents 
10
Introduction to multivariate calibration : a practical approach /
Book
Subject (ZB): ...computer application...
Table of Contents 
11
Applied theoretical organic chemistry /
Book
Subject (ZB): ...computational chemistry...
Table of Contents 
12
Computational Drug Discovery and Design [E-Book] /
Subject (ZB): ...computational chemistry...

Full text 
13
Reactive transport modeling : applications in subsurface energy and environmental problems /
Book
Subject (ZB): ...computer modeling...
Table of Contents 
14
Fundamentals of computational chemistry /
Book
Subject (ZB): ...computational chemistry...
Table of Contents 
15
Introduction to Multivariate Calibration [E-Book] : A Practical Approach /
16
Learn Aspen Plus in 24 hours /
Book
Subject (ZB): ...computer modeling...
Table of Contents 
17
Chemoinformatics : basic concepts and methods /
Book
Subject (ZB): ...computational chemistry...
Table of Contents 
18
Applied chemoinformatics : achievements and future opportunities /
Book
Subject (ZB): ...computational chemistry...
Table of Contents 
19
Chemical modelling. Volume 13 [E-Book] /
Subject (ZB): ...computational chemistry...

Full text 
20
Handbook of Computational Chemistry [E-Book] /