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Application

Discovery Studio 0.8867201362765278 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06898528568698643 Amorphous Cell 0.2860691763806612 Blends 0.0025797821517294095 CASTEP 0.4012038983374737 CDOCKER 0.1528759793617428 CHARMm 0.2389642652398242 COMPASS 0.3720619147716415 COMPASS III 0.08264857634244219 COSMObase 0.0034397095356392127 COSMOconf 0.004012994458245748 COSMOmic 1.9109497420217848E-4 COSMOperm 0.0015287597936174278 COSMOplex 2.866424613032677E-4 COSMOquick 0.0013376648194152493 COSMOtherm 0.06420791133193197 Cantera 0.0 Catalyst 0.11245939231798203 Classical Simulations 1.0 Conformers 9.554748710108924E-4 Crystallization 0.07624689470666922 DFTB Plus 0.005732849226065355 DMol3 0.18154022549206955 DPD 0.002770877125931588 Discover 0.003535257022740302 Forcite 0.548155933498949 GULP 0.025797821517294095 Kinetix 2.866424613032677E-4 LUDI 0.003917446971144659 LibDock 0.06497229122874068 LigandFit 0.00506401681635773 MCSS 4.777374355054462E-4 MODELER 0.17714504108541945 MesoDyn 0.0010510223581119817 Mesocite 0.004012994458245748 Mesoscale 0.007166061532581693 Modules 0.0 Morphology 0.018154022549206957 ONETEP 0.0010510223581119817 Polymorph 0.0019109497420217848 QMERA 1.9109497420217848E-4 QSAR 0.0010510223581119817 Quantum Mechanics 0.5715650678387159 Reflex 0.055704184979935026 Reflex Plus 8.599273839098032E-4 Semi-empirical 0.0077393464551882285 Sorption 0.05761513472195681 Synthia 0.0014332123065163387 TURBOMOLE 5.732849226065354E-4 VAMP 0.0016243072807185172 Visualization 0.7731702656220142 X-Cell 0.0013376648194152493 ZDOCK 0.026848843875406078

Year

2022 0.05910248529024326 2023 0.3403003424958286 2024 0.7394397119522262 2025 1.0 2026 0.373320453148327 2027 0.0

Keywords

target 1.0 potential 0.27332620320855616 docking 0.19948663101604278 analysis 0.18862032085561498 visualization 0.1872513368983957 between 0.1572192513368984 novel 0.09664171122994653 energy 0.09450267379679145 cell 0.06575401069518716 binding 0.06228877005347594 promising 0.05754010695187166 activity 0.045390374331550805 stability 0.038844919786096256 performance 0.0347807486631016 interaction 0.034481283422459895 experimental 0.03272727272727273 synthesized 0.028491978609625667 effective 0.020705882352941178 mechanism 0.020620320855614972 development 0.01758288770053476 including 0.01570053475935829 synthesis 0.008470588235294117 protein 0.007871657754010695 design 5.133689839572192E-4 chemical 0.0
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