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Application

Discovery Studio 0.8419639764461379 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06817920073707244 Amorphous Cell 0.28814925716918116 Blends 0.0023033513762524475 CASTEP 0.3825866635955315 CDOCKER 0.14752965564896925 CHARMm 0.2343660025336865 COMPASS 0.3706092364390188 COMPASS III 0.09029137394909593 COSMObase 0.004030864908441783 COSMOconf 0.00437636761487965 COSMOmic 1.1516756881262236E-4 COSMOperm 0.0013820108257514684 COSMOplex 1.1516756881262236E-4 COSMOquick 0.0014971783945640907 COSMOtherm 0.06495450881031901 Catalyst 0.09351606587584936 Classical Simulations 1.0 Conformers 8.061729816883565E-4 Crystallization 0.07647126569158125 DFTB Plus 0.005182540596568006 DMol3 0.17551537487043647 DPD 0.002533686513877692 Discover 0.003455027064378671 Forcite 0.5529194978694 GULP 0.02395485431302545 Kinetix 2.3033513762524472E-4 LUDI 0.003455027064378671 LibDock 0.061499481745940346 LigandFit 0.0042612000460670275 MCSS 4.6067027525048944E-4 MODELER 0.19578486698145803 MesoDyn 0.001266843256938846 Mesocite 0.003800529770816538 Mesoscale 0.006910054128757342 Modules 0.0 Morphology 0.018311643441206955 ONETEP 8.061729816883565E-4 Polymorph 0.0018426811010019578 QMERA 1.1516756881262236E-4 QSAR 9.213405505009789E-4 Quantum Mechanics 0.5467004491535183 Reflex 0.0556259357364966 Reflex Plus 0.0010365081193136013 Semi-empirical 0.007025221697569964 Sorption 0.05838995738799954 Synthia 0.0013820108257514684 TURBOMOLE 4.6067027525048944E-4 VAMP 0.0014971783945640907 Visualization 0.7101232292986295 X-Cell 0.0014971783945640907 ZDOCK 0.024645859725901186

Year

2022 0.004739336492890996 2023 0.18454976303317536 2024 0.5854028436018958 2025 1.0 2026 0.4029383886255924 2027 0.0

Keywords

target 1.0 potential 0.27791496671677046 analysis 0.1912175220098776 docking 0.18982177367403907 visualization 0.16883186600815975 between 0.1564311788705175 novel 0.09464247369551214 energy 0.09437406055400473 cell 0.06613699806742539 promising 0.06243289671462315 binding 0.05679622074296758 performance 0.04144298904874383 activity 0.03897358814687567 stability 0.038007300837449 experimental 0.030545415503543054 interaction 0.02619712261112304 synthesized 0.02453296113377711 effective 0.019755207214945242 including 0.01830577625080524 development 0.016480566888554864 mechanism 0.016104788490444492 synthesis 0.003113592441485935 enhanced 0.002737814043375564 protein 0.0012347004509340777 design 0.0
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