Computational Chemistry is the study of complex chemical problems using a combination of computer simulations, chemistry theory and information science. Also called cheminformatics, this field enables ...

Mass spectrometers are high-tech machines that play an important role in our society. They are highly sensitive analytical instruments that are indispensable in areas such as medical diagnostics, food ...

Scientists from the laboratory of Dr. Tomáš Pluskal at IOCB Prague are helping colleagues around the world identify previously unknown compounds. They have created an extensive library called MS n Lib ...