Index of /tinker/distribution/source

      Name                    Last modified      Size  Description
Parent Directory - epolar1.f 2024-05-12 18:20 384K unionball.f 2024-05-12 18:20 357K induce.f 2024-05-12 18:20 247K crystal.f 2024-05-12 18:20 234K esolv1.f 2024-05-12 18:20 225K poledit.f 2024-05-12 18:20 140K empole1.f 2024-05-12 18:20 135K valence.f 2024-05-12 18:20 110K embed.f 2024-05-12 18:20 110K epolar2.f 2024-05-12 18:20 103K connolly.f 2024-05-12 18:20 101K analyze.f 2024-05-12 18:20 93K estrtor2.f 2024-05-12 18:20 87K pdbxyz.f 2024-05-12 18:20 83K eangtor2.f 2024-05-12 18:20 83K etortor2.f 2024-05-12 18:20 82K potential.f 2024-05-12 18:20 80K initneck.f 2024-05-12 18:20 76K epolar3.f 2024-05-12 18:20 74K empole3.f 2024-05-12 18:20 74K egeom2.f 2024-05-12 18:20 74K edipole2.f 2024-05-12 18:20 73K esolv3.f 2024-05-12 18:20 72K echgdpl2.f 2024-05-12 18:20 72K echarge1.f 2024-05-12 18:20 71K etors2.f 2024-05-12 18:20 68K echarge3.f 2024-05-12 18:20 68K xyzpdb.f 2024-05-12 18:20 67K xyzedit.f 2024-05-12 18:20 66K prmedit.f 2024-05-12 18:20 66K esolv.f 2024-05-12 18:20 63K ksolv.f 2024-05-12 18:20 63K epolar.f 2024-05-12 18:20 62K empole.f 2024-05-12 18:20 60K pmestuf.f 2024-05-12 18:20 60K readprm.f 2024-05-12 18:20 60K protein.f 2024-05-12 18:20 59K edisp1.f 2024-05-12 18:20 59K vibbig.f 2024-05-12 18:20 55K erepel1.f 2024-05-12 18:20 55K emm3hb1.f 2024-05-12 18:20 54K nblist.f 2024-05-12 18:20 52K edisp3.f 2024-05-12 18:20 50K nucleic.f 2024-05-12 18:20 50K echarge.f 2024-05-12 18:20 49K hybrid.f 2024-05-12 18:20 48K prtprm.f 2024-05-12 18:20 46K elj1.f 2024-05-12 18:20 44K readpdb.f 2024-05-12 18:20 44K edisp.f 2024-05-12 18:20 43K final.f 2024-05-12 18:20 43K ktors.f 2024-05-12 18:20 42K egauss1.f 2024-05-12 18:20 42K echarge2.f 2024-05-12 18:20 41K elj3.f 2024-05-12 18:20 40K emm3hb3.f 2024-05-12 18:20 40K born.f 2024-05-12 18:20 39K ehal1.f 2024-05-12 18:20 39K richmond.f 2024-05-12 18:20 39K egauss3.f 2024-05-12 18:20 38K elj2.f 2024-05-12 18:20 37K square.f 2024-05-12 18:20 36K bar.f 2024-05-12 18:20 36K damping.f 2024-05-12 18:20 36K ebuck1.f 2024-05-12 18:20 36K pmpb.c 2021-07-16 20:57 35K egauss2.f 2024-05-12 18:20 35K ehal3.f 2024-05-12 18:20 34K fftpack.f 2024-05-12 18:20 34K empole2.f 2024-05-12 18:20 33K erepel2.f 2024-05-12 18:20 33K ebuck3.f 2024-05-12 18:20 33K torsfit.f 2024-05-12 18:20 32K kangle.f 2024-05-12 18:20 32K eimptor2.f 2024-05-12 18:20 32K kundrot.f 2024-05-12 18:20 32K saddle.f 2024-05-12 18:20 32K emm3hb.f 2024-05-12 18:20 32K eimprop2.f 2024-05-12 18:20 31K tncg.f 2024-05-12 18:20 31K pss.f 2024-05-12 18:20 31K eangle2.f 2024-05-12 18:20 31K elj.f 2024-05-12 18:20 31K surfatom.f 2024-05-12 18:20 30K xtalfit.f 2024-05-12 18:20 30K erepel3.f 2024-05-12 18:20 29K testgrad.f 2024-05-12 18:20 29K emm3hb2.f 2024-05-12 18:20 29K erxnfld.f 2024-05-12 18:20 29K egauss.f 2024-05-12 18:20 28K echgtrn3.f 2024-05-12 18:20 28K egeom1.f 2024-05-12 18:20 27K kpolar.f 2024-05-12 18:20 26K dexpol.f 2024-05-12 18:20 26K ebuck2.f 2024-05-12 18:20 26K ehal.f 2024-05-12 18:20 26K prmkey.f 2024-05-12 18:20 25K picalc.f 2024-05-12 18:20 25K kstrbnd.f 2024-05-12 18:20 25K ebuck.f 2024-05-12 18:20 24K erepel.f 2024-05-12 18:20 24K tcgstuf.f 2024-05-12 18:20 24K ehal2.f 2024-05-12 18:20 23K pressure.f 2024-05-12 18:20 23K kmpole.f 2024-05-12 18:20 23K kvdw.f 2024-05-12 18:20 22K testpair.f 2024-05-12 18:20 22K egeom3.f 2024-05-12 18:20 21K echgtrn.f 2024-05-12 18:20 21K prtmol2.f 2024-05-12 18:20 21K monte.f 2024-05-12 18:20 21K distgeom.f 2024-05-12 18:20 21K etors1.f 2024-05-12 18:20 21K kbond.f 2024-05-12 18:20 20K setprm.f 2024-05-12 18:20 20K estrbnd2.f 2024-05-12 18:20 20K echgtrn1.f 2024-05-12 18:20 20K scan.f 2024-05-12 18:20 20K arcedit.f 2024-05-12 18:20 19K rattle.f 2024-05-12 18:20 19K initprm.f 2024-05-12 18:20 19K xtalmin.f 2024-05-12 18:20 18K testpol.f 2024-05-12 18:20 18K pssrigid.f 2024-05-12 18:20 18K ocvm.f 2024-05-12 18:20 18K sort.f 2024-05-12 18:20 17K testhess.f 2024-05-12 18:20 17K edipole1.f 2024-05-12 18:20 17K alterpol.f 2024-05-12 18:20 17K superpose.f 2024-05-12 18:20 17K document.f 2024-05-12 18:20 17K esolv2.f 2024-05-12 18:20 16K edisp2.f 2024-05-12 18:20 16K eopdist2.f 2024-05-12 18:20 16K etors3.f 2024-05-12 18:20 16K .kvdw.f.swp 2023-10-01 15:22 16K alchemy.f 2024-05-12 18:20 16K pssrot.f 2024-05-12 18:20 16K rings.f 2024-05-12 18:20 15K kgeom.f 2024-05-12 18:20 15K kimptor.f 2024-05-12 18:20 15K shakeup.f 2024-05-12 18:20 15K server.c 2021-04-23 08:25 15K mdinit.f 2024-05-12 18:20 15K testrot.f 2024-05-12 18:20 14K diffeq.f 2024-05-12 18:20 14K polarize.f 2024-05-12 18:20 14K freefix.f 2024-05-12 18:20 14K egeom.f 2024-05-12 18:20 14K eangle1.f 2024-05-12 18:20 14K etortor1.f 2024-05-12 18:20 13K correlate.f 2024-05-12 18:20 13K estrtor1.f 2024-05-12 18:20 13K echgtrn2.f 2024-05-12 18:20 13K torque.f 2024-05-12 18:20 13K echgdpl1.f 2024-05-12 18:20 13K readgdma.f 2024-05-12 18:20 13K kopbend.f 2024-05-12 18:20 13K etors.f 2024-05-12 18:20 13K sniffer.f 2024-05-12 18:20 13K mutate.f 2024-05-12 18:20 13K overlap.f 2024-05-12 18:20 13K rgdstep.f 2024-05-12 18:20 13K kimprop.f 2024-05-12 18:20 13K lbfgs.f 2024-05-12 18:20 13K rotpole.f 2024-05-12 18:20 12K intedit.f 2024-05-12 18:20 12K epitors2.f 2024-05-12 18:20 12K eangtor1.f 2024-05-12 18:20 12K emetal1.f 2024-05-12 18:20 12K gda.f 2024-05-12 18:20 12K temper.f 2024-05-12 18:20 12K orient.f 2024-05-12 18:20 12K makeint.f 2024-05-12 18:20 12K kewald.f 2024-05-12 18:20 12K lights.f 2024-05-12 18:20 12K kdipole.f 2024-05-12 18:20 12K path.f 2024-05-12 18:20 12K cutoffs.f 2024-05-12 18:20 12K sdstep.f 2024-05-12 18:20 11K initres.f 2024-05-12 18:20 11K kcharge.f 2024-05-12 18:20 11K eopbend2.f 2024-05-12 18:20 11K radial.f 2024-05-12 18:20 11K readgau.f 2024-05-12 18:20 11K orbital.f 2024-05-12 18:20 11K respa.f 2024-05-12 18:20 11K exfield.f 2024-05-12 18:20 11K eangang2.f 2024-05-12 18:20 11K diagq.f 2024-05-12 18:20 11K newton.f 2024-05-12 18:20 11K evcorr.f 2024-05-12 18:20 11K mdsave.f 2024-05-12 18:20 11K mdstat.f 2024-05-12 18:20 11K volume.f 2024-05-12 18:20 11K image.f 2024-05-12 18:20 11K epitors1.f 2024-05-12 18:20 10K initrot.f 2024-05-12 18:20 10K critical.f 2024-05-12 18:20 10K diffuse.f 2024-05-12 18:20 10K edipole3.f 2024-05-12 18:20 10K vibrate.f 2024-05-12 18:20 10K dynamic.f 2024-05-12 18:20 10K simplex.f 2024-05-12 18:20 10K search.f 2024-05-12 18:20 9.9K korbit.f 2024-05-12 18:20 9.9K qrsolve.f 2024-05-12 18:20 9.8K newtrot.f 2024-05-12 18:20 9.7K server.f 2024-05-12 18:20 9.7K sktstuf.f 2024-05-12 18:20 9.7K merck.f 2024-05-12 18:20 9.6K eangle3.f 2024-05-12 18:20 9.4K anneal.f 2024-05-12 18:20 9.4K etortor.f 2024-05-12 18:20 9.4K eopbend1.f 2024-05-12 18:20 9.4K moments.f 2024-05-12 18:20 9.2K kstrtor.f 2024-05-12 18:20 9.2K echgdpl3.f 2024-05-12 18:20 9.2K random.f 2024-05-12 18:20 9.1K mdrest.f 2024-05-12 18:20 9.1K erf.f 2024-05-12 18:20 9.1K surface.f 2024-05-12 18:20 8.8K ktortor.f 2024-05-12 18:20 8.7K gradrot.f 2024-05-12 18:20 8.6K katom.f 2024-05-12 18:20 8.6K kopdist.f 2024-05-12 18:20 8.5K minimize.f 2024-05-12 18:20 8.4K bicubic.f 2024-05-12 18:20 8.4K neck.f 2024-05-12 18:20 8.4K etortor3.f 2024-05-12 18:20 8.4K optsave.f 2024-05-12 18:20 8.3K eimptor1.f 2024-05-12 18:20 8.2K optimize.f 2024-05-12 18:20 8.0K gradient.f 2024-05-12 18:20 8.0K testsurf.f 2024-05-12 18:20 7.9K prtarc.f 2024-05-12 18:20 7.9K testvir.f 2024-05-12 18:20 7.9K prtuind.f 2024-05-12 18:20 7.9K eangang1.f 2024-05-12 18:20 7.9K cluster.f 2024-05-12 18:20 7.8K eimprop1.f 2024-05-12 18:20 7.8K nose.f 2024-05-12 18:20 7.8K ghmcstep.f 2024-05-12 18:20 7.7K initatom.f 2024-05-12 18:20 7.6K hessian.f 2024-05-12 18:20 7.6K cspline.f 2024-05-12 18:20 7.5K kchgflx.f 2024-05-12 18:20 7.5K estrtor3.f 2024-05-12 18:20 7.4K fft3d.f 2024-05-12 18:20 7.4K kangtor.f 2024-05-12 18:20 7.4K analysis.f 2024-05-12 18:20 7.3K eangtor3.f 2024-05-12 18:20 7.3K chkring.f 2024-05-12 18:20 7.2K epitors3.f 2024-05-12 18:20 7.2K invbeta.f 2024-05-12 18:20 7.1K estrbnd1.f 2024-05-12 18:20 6.9K active.f 2024-05-12 18:20 6.9K prtfrc.f 2024-05-12 18:20 6.8K prtvel.f 2024-05-12 18:20 6.8K prtxyz.f 2024-05-12 18:20 6.8K edipole.f 2024-05-12 18:20 6.7K optrigid.f 2024-05-12 18:20 6.7K minrigid.f 2024-05-12 18:20 6.7K eangle.f 2024-05-12 18:20 6.7K alterchg.f 2024-05-12 18:20 6.7K optirot.f 2024-05-12 18:20 6.7K minirot.f 2024-05-12 18:20 6.7K predict.f 2024-05-12 18:20 6.6K numeral.f 2024-05-12 18:20 6.4K eopdist1.f 2024-05-12 18:20 6.4K eimptor3.f 2024-05-12 18:20 6.3K baoab.f 2024-05-12 18:20 6.3K kinetic.f 2024-05-12 18:20 6.3K readxyz.f 2024-05-12 18:20 6.2K eopbend3.f 2024-05-12 18:20 6.2K spacefill.f 2024-05-12 18:20 6.2K echgdpl.f 2024-05-12 18:20 6.1K bussi.f 2024-05-12 18:20 6.0K kurey.f 2024-05-12 18:20 6.0K xyzatm.f 2024-05-12 18:20 5.9K eimprop3.f 2024-05-12 18:20 5.9K prtpdb.f 2024-05-12 18:20 5.8K estrtor.f 2024-05-12 18:20 5.7K eangang3.f 2024-05-12 18:20 5.7K eangtor.f 2024-05-12 18:20 5.6K kchgtrn.f 2024-05-12 18:20 5.6K trimtext.f 2024-05-12 18:20 5.6K faces.f 2024-05-12 18:20 5.6K timer.f 2024-05-12 18:20 5.5K emetal.f 2024-05-12 18:20 5.5K krepel.f 2024-05-12 18:20 5.4K epitors.f 2024-05-12 18:20 5.4K dcflux.f 2024-05-12 18:20 5.4K timerot.f 2024-05-12 18:20 5.1K inertia.f 2024-05-12 18:20 5.1K kexpol.f 2024-05-12 18:20 5.0K rotlist.f 2024-05-12 18:20 5.0K eopdist3.f 2024-05-12 18:20 5.0K estrbnd3.f 2024-05-12 18:20 5.0K lattice.f 2024-05-12 18:20 4.9K resdue.f 2024-05-12 18:20 4.9K jacobi.f 2024-05-12 18:20 4.9K kdisp.f 2024-05-12 18:20 4.9K getprm.f 2024-05-12 18:20 4.8K eopbend.f 2024-05-12 18:20 4.8K readmol2.f 2024-05-12 18:20 4.8K zatom.f 2024-05-12 18:20 4.8K initial.f 2024-05-12 18:20 4.7K readint.f 2024-05-12 18:20 4.7K getkey.f 2024-05-12 18:20 4.7K kpitors.f 2024-05-12 18:20 4.7K beeman.f 2024-05-12 18:20 4.7K eimptor.f 2024-05-12 18:20 4.7K readdyn.f 2024-05-12 18:20 4.6K potfit.f 2024-05-12 18:20 4.6K switch.f 2024-05-12 18:20 4.6K ebond1.f 2024-05-12 18:20 4.6K readdcd.f 2024-05-12 18:20 4.5K unitcell.f 2024-05-12 18:20 4.4K eimprop.f 2024-05-12 18:20 4.4K replica.f 2024-05-12 18:20 4.3K erxnfld3.f 2024-05-12 18:20 4.3K ebond3.f 2024-05-12 18:20 4.3K pmpb.f 2024-05-12 18:20 4.2K prtdcd.arc 2022-07-30 19:01 4.2K spectrum.f 2024-05-12 18:20 4.2K eangang.f 2024-05-12 18:20 4.2K prtdyn.f 2024-05-12 18:20 4.2K units.f 2024-05-12 18:20 4.1K pbstuf.f 2024-05-12 18:20 4.1K groups.f 2024-05-12 18:20 4.1K readseq.f 2024-05-12 18:20 4.1K ebond2.f 2024-05-12 18:20 4.1K attach.f 2024-05-12 18:20 4.1K verlet.f 2024-05-12 18:20 4.1K ascii.f 2024-05-12 18:20 4.1K getnumb.f 2024-05-12 18:20 4.0K neigh.f 2024-05-12 18:20 4.0K flatten.f 2024-05-12 18:20 4.0K energy.f 2024-05-12 18:20 3.9K eurey1.f 2024-05-12 18:20 3.9K eurey3.f 2024-05-12 18:20 3.9K lusolve.f 2024-05-12 18:20 3.8K bounds.f 2024-05-12 18:20 3.8K getcart.f 2024-05-12 18:20 3.8K getarc.f 2024-05-12 18:20 3.7K solute.f 2024-05-12 18:20 3.7K deflate.f 2024-05-12 18:20 3.7K molecule.f 2024-05-12 18:20 3.7K kangang.f 2024-05-12 18:20 3.6K polymer.f 2024-05-12 18:20 3.6K quatfit.f 2024-05-12 18:20 3.6K estrbnd.f 2024-05-12 18:20 3.6K eopdist.f 2024-05-12 18:20 3.5K deriv.f 2024-05-12 18:20 3.5K getstring.f 2024-05-12 18:20 3.4K prtint.f 2024-05-12 18:20 3.4K analyz.f 2024-05-12 18:20 3.4K version.f 2024-05-12 18:20 3.4K potent.f 2024-05-12 18:20 3.4K field.f 2024-05-12 18:20 3.3K eurey2.f 2024-05-12 18:20 3.3K restrn.f 2024-05-12 18:20 3.3K grpline.f 2024-05-12 18:20 3.3K domega.f 2024-05-12 18:20 3.2K gradrgd.f 2024-05-12 18:20 3.2K getdcd.f 2024-05-12 18:20 3.2K invert.f 2024-05-12 18:20 3.2K readmol.f 2024-05-12 18:20 3.2K polpot.f 2024-05-12 18:20 3.2K shapes.f 2024-05-12 18:20 3.1K chkpole.f 2024-05-12 18:20 3.0K ktorsn.f 2024-05-12 18:20 3.0K cholesky.f 2024-05-12 18:20 3.0K mechanic.f 2024-05-12 18:20 3.0K kangs.f 2024-05-12 18:20 3.0K impose.f 2024-05-12 18:20 3.0K getword.f 2024-05-12 18:20 2.9K control.f 2024-05-12 18:20 2.9K ebond.f 2024-05-12 18:20 2.9K boxes.f 2024-05-12 18:20 2.9K vibrot.f 2024-05-12 18:20 2.8K geometry.f 2024-05-12 18:20 2.8K limits.f 2024-05-12 18:20 2.8K hessrot.f 2024-05-12 18:20 2.7K polar.f 2024-05-12 18:20 2.6K angles.f 2024-05-12 18:20 2.6K action.f 2024-05-12 18:20 2.6K number.f 2024-05-12 18:20 2.6K pme.f 2024-05-12 18:20 2.6K xyzint.f 2024-05-12 18:20 2.6K energi.f 2024-05-12 18:20 2.5K chksymm.f 2024-05-12 18:20 2.5K nonpol.f 2024-05-12 18:20 2.5K gettext.f 2024-05-12 18:20 2.5K kbonds.f 2024-05-12 18:20 2.5K bath.f 2024-05-12 18:20 2.5K hpmf.f 2024-05-12 18:20 2.5K nspline.f 2024-05-12 18:20 2.5K basefile.f 2024-05-12 18:20 2.4K getint.f 2024-05-12 18:20 2.4K makeref.f 2024-05-12 18:20 2.4K refer.f 2024-05-12 18:20 2.4K eurey.f 2024-05-12 18:20 2.4K pdb.f 2024-05-12 18:20 2.3K vdwpot.f 2024-05-12 18:20 2.3K vdw.f 2024-05-12 18:20 2.2K angpot.f 2024-05-12 18:20 2.1K bitors.f 2024-05-12 18:20 2.1K getxyz.f 2024-05-12 18:20 2.1K center.f 2024-05-12 18:20 2.1K korbs.f 2024-05-12 18:20 2.1K kdipol.f 2024-05-12 18:20 2.1K uprior.f 2024-05-12 18:20 2.1K clock.f 2024-05-12 18:20 2.1K hessrgd.f 2024-05-12 18:20 2.0K light.f 2024-05-12 18:20 2.0K torsions.f 2024-05-12 18:20 2.0K column.f 2024-05-12 18:20 2.0K piorbs.f 2024-05-12 18:20 2.0K suffix.f 2024-05-12 18:20 2.0K mutant.f 2024-05-12 18:20 2.0K bonds.f 2024-05-12 18:20 1.9K shunt.f 2024-05-12 18:20 1.9K delete.f 2024-05-12 18:20 1.9K chkxyz.f 2024-05-12 18:20 1.9K prtseq.f 2024-05-12 18:20 1.9K numgrad.f 2024-05-12 18:20 1.9K insert.f 2024-05-12 18:20 1.9K math.f 2024-05-12 18:20 1.9K connect.f 2024-05-12 18:20 1.9K polgrp.f 2024-05-12 18:20 1.9K maxwell.f 2024-05-12 18:20 1.8K ktrtor.f 2024-05-12 18:20 1.8K mpole.f 2024-05-12 18:20 1.8K getmol2.f 2024-05-12 18:20 1.8K polopt.f 2024-05-12 18:20 1.8K optinit.f 2024-05-12 18:20 1.8K getpdb.f 2024-05-12 18:20 1.8K moment.f 2024-05-12 18:20 1.8K getmol.f 2024-05-12 18:20 1.8K command.f 2024-05-12 18:20 1.7K getref.f 2024-05-12 18:20 1.7K merge.f 2024-05-12 18:20 1.7K openend.f 2024-05-12 18:20 1.7K ielscf.f 2024-05-12 18:20 1.7K output.f 2024-05-12 18:20 1.6K sizes.f 2024-05-12 18:20 1.6K xyzmol2.f 2024-05-12 18:20 1.6K torphase.f 2024-05-12 18:20 1.6K xtals.f 2024-05-12 18:20 1.5K calendar.f 2024-05-12 18:20 1.5K orthog.f 2024-05-12 18:20 1.5K ring.f 2024-05-12 18:20 1.5K inform.f 2024-05-12 18:20 1.5K rgddyn.f 2024-05-12 18:20 1.5K warp.f 2024-05-12 18:20 1.5K mrecip.f 2024-05-12 18:20 1.5K freeze.f 2024-05-12 18:20 1.5K dma.f 2024-05-12 18:20 1.5K group.f 2024-05-12 18:20 1.5K repel.f 2024-05-12 18:20 1.5K chgpot.f 2024-05-12 18:20 1.5K chunks.f 2024-05-12 18:20 1.5K promo.f 2024-05-12 18:20 1.5K freeunit.f 2024-05-12 18:20 1.4K tors.f 2024-05-12 18:20 1.4K qmstuf.f 2024-05-12 18:20 1.4K couple.f 2024-05-12 18:20 1.4K expol.f 2024-05-12 18:20 1.4K poltcg.f 2024-05-12 18:20 1.4K gyrate.f 2024-05-12 18:20 1.4K intxyz.f 2024-05-12 18:20 1.4K sigmoid.f 2024-05-12 18:20 1.4K nextarg.f 2024-05-12 18:20 1.4K paths.f 2024-05-12 18:20 1.3K kcflux.f 2024-05-12 18:20 1.3K rmsfit.f 2024-05-12 18:20 1.3K mol2xyz.f 2024-05-12 18:20 1.3K cell.f 2024-05-12 18:20 1.3K molxyz.f 2024-05-12 18:20 1.3K valfit.f 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