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mol2rtp Version: 1.0 Author: Evgeniy Alexeev aka arcanis Email: esalexeev@gmail.com mol2rtp convert *.mol2 file in GROMACS topology file (*.rtp). Usage: mol2rtp [MOL2.FILE] [RTP.FILE] For example: mol2rtp exmpl.mol2 exmpl.rtp NOTE: You must edit molecular mechanics atom types in output *.rtp-file, because atom types in *.mol2 file don't match GROMACS atom types. Compile: gcc mol2rtp.c -o mol2rtp Dependence: * gcc * libs: string.h, stdlib.h, stdio.h