# vim:ft=plumed #################################### # >> Alanine Dipeptide << # Aux. file - list of descriptors #################################### # Define descriptors d1: DISTANCE ATOMS=2,5 d2: DISTANCE ATOMS=2,6 d3: DISTANCE ATOMS=2,7 d4: DISTANCE ATOMS=2,9 d5: DISTANCE ATOMS=2,11 d6: DISTANCE ATOMS=2,15 d7: DISTANCE ATOMS=2,16 d8: DISTANCE ATOMS=2,17 d9: DISTANCE ATOMS=2,19 d10: DISTANCE ATOMS=5,6 d11: DISTANCE ATOMS=5,7 d12: DISTANCE ATOMS=5,9 d13: DISTANCE ATOMS=5,11 d14: DISTANCE ATOMS=5,15 d15: DISTANCE ATOMS=5,16 d16: DISTANCE ATOMS=5,17 d17: DISTANCE ATOMS=5,19 d18: DISTANCE ATOMS=6,7 d19: DISTANCE ATOMS=6,9 d20: DISTANCE ATOMS=6,11 d21: DISTANCE ATOMS=6,15 d22: DISTANCE ATOMS=6,16 d23: DISTANCE ATOMS=6,17 d24: DISTANCE ATOMS=6,19 d25: DISTANCE ATOMS=7,9 d26: DISTANCE ATOMS=7,11 d27: DISTANCE ATOMS=7,15 d28: DISTANCE ATOMS=7,16 d29: DISTANCE ATOMS=7,17 d30: DISTANCE ATOMS=7,19 d31: DISTANCE ATOMS=9,11 d32: DISTANCE ATOMS=9,15 d33: DISTANCE ATOMS=9,16 d34: DISTANCE ATOMS=9,17 d35: DISTANCE ATOMS=9,19 d36: DISTANCE ATOMS=11,15 d37: DISTANCE ATOMS=11,16 d38: DISTANCE ATOMS=11,17 d39: DISTANCE ATOMS=11,19 d40: DISTANCE ATOMS=15,16 d41: DISTANCE ATOMS=15,17 d42: DISTANCE ATOMS=15,19 d43: DISTANCE ATOMS=16,17 d44: DISTANCE ATOMS=16,19 d45: DISTANCE ATOMS=17,19