| 1 | Journal of Computational Chemistry | 11 | 2.1K | 83 | 140 |
| 2 | Journal of Physical Chemistry B | 24 | 1.5K | 275 | 528 |
| 3 | Journal of the American Chemical Society | 13 | 1.1K | 5596 | 8701 |
| 4 | Journal of Chemical Physics | 9 | 986 | 8278 | 3658 |
| 5 | The Journal of Physical Chemistry | 12 | 898 | 652 | 523 |
| 6 | Journal of Chemical Theory and Computation | 13 | 657 | 269 | 610 |
| 7 | Journal of Molecular Biology | 5 | 556 | 3497 | 2908 |
| 8 | Proceedings of the National Academy of Sciences of the United States of America | 7 | 530 | 14723 | 64913 |
| 9 | Chemical Physics Letters | 7 | 351 | 2547 | 1834 |
| 10 | Protein Engineering, Design and Selection | 3 | 310 | 458 | 284 |
| 11 | Journal of Medicinal Chemistry | 3 | 295 | 10963 | 7548 |
| 12 | Cell | 1 | 293 | 17295 | 35589 |
| 13 | Macromolecules | 1 | 259 | 15428 | 5819 |
| 13 | Annual Review of Physical Chemistry | 1 | 259 | 184 | 397 |
| 15 | Journal of Biomolecular NMR | 6 | 235 | 497 | 544 |
| 16 | Proteins: Structure, Function and Bioinformatics | 3 | 234 | 858 | 770 |
| 17 | Current Opinion in Structural Biology | 4 | 224 | 220 | 772 |
| 18 | Molecular Cell | 1 | 220 | 6614 | 9726 |
| 19 | Journal of Chemical Information and Modeling | 4 | 209 | 879 | 1068 |
| 20 | Biochemistry | 2 | 196 | 19992 | 15329 |
| 21 | Journal of Computer-Aided Molecular Design | 6 | 163 | 116 | 415 |
| 22 | Journal of Physical Chemistry A | 1 | 131 | 15504 | 6531 |
| 23 | Protein Science | 5 | 130 | 341 | 1656 |
| 24 | Biophysical Journal | 4 | 118 | 2955 | 8514 |
| 25 | Nature | 1 | 110 | 60010 | 64962 |
| 26 | Advances in Protein Chemistry and Structural Biology | 1 | 109 | 144 | 74 |
| 27 | Folding & Design | 1 | 100 | 45 | 68 |
| 28 | Journal of Theoretical Biology | 1 | 78 | 4980 | 3328 |
| 29 | PLoS Computational Biology | 2 | 77 | 2785 | 7065 |
| 30 | Computer Physics Communications | 2 | 71 | 1639 | 2425 |
| 31 | Journal of Magnetic Resonance | 2 | 70 | 1573 | 1699 |
| 32 | Nature Communications | 2 | 66 | 45297 | 64915 |
| 33 | Molecular Biology and Evolution | 1 | 60 | 7040 | 11221 |
| 34 | Journal of Physical Chemistry Letters | 3 | 55 | 3746 | 12605 |
| 35 | Bioinformatics | 1 | 50 | 14760 | 18977 |
| 36 | Retrovirology | 1 | 41 | 2644 | 2990 |
| 37 | Physical Chemistry Chemical Physics | 1 | 38 | 31141 | 32405 |
| 38 | Science Advances | 1 | 37 | 17837 | 62680 |
| 38 | Journal of Structural and Functional Genomics | 1 | 37 | 324 | 513 |
| 40 | The International Journal of Supercomputer Applications | 1 | 33 | 21 | 25 |
| 41 | Journal of Molecular Recognition | 1 | 32 | 463 | 679 |
| 42 | Physical Review E | 1 | 30 | 21539 | 22234 |
| 42 | Chemical Physics | 2 | 30 | 2976 | 6253 |
| 44 | BMC Bioinformatics | 1 | 27 | 7566 | 13580 |
| 45 | Journal of Biological Chemistry | 1 | 26 | 56099 | 64886 |
| 46 | Biophysical Chemistry | 1 | 24 | 2126 | 3510 |
| 47 | Viruses | 2 | 23 | 10428 | 24227 |
| 48 | Physical Review Letters | 1 | 15 | 53648 | 64830 |
| 48 | Acta Crystallographica Section D: Biological Crystallography | 1 | 15 | 3760 | 5810 |
| 50 | PLoS ONE | 1 | 11 | 42279 | 64652 |
| 51 | Scientific Reports | 1 | 10 | 48134 | 64753 |
| 51 | Biopolymers | 1 | 10 | 1615 | 4446 |
| 53 | Advances in Chemistry Series | 1 | 9 | 326 | 1009 |
| 54 | Computers & Chemistry | 1 | 8 | 189 | 444 |
| 55 | Journal of Molecular Graphics | 1 | 6 | 162 | 292 |
| 56 | Advances in Chemical Physics | 1 | 4 | 157 | 672 |
| 57 | Journal of Biomolecular Structure and Dynamics | 1 | 3 | 4181 | 11522 |
| 58 | Israel Journal of Chemistry | 1 | 2 | 384 | 3071 |
| 58 | Lecture Notes in Computational Science and Engineering | 1 | 2 | 1365 | 2123 |
| 58 | Journal of Magnetic Resonance | 1 | 2 | 1149 | 1973 |
| 61 | ACS Symposium Series | 1 | 0 | 4816 | 17631 |
