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Application

Discovery Studio 0.8510094556606185 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06784492588369441 Amorphous Cell 0.287115165336374 Blends 0.002508551881413911 CASTEP 0.39657924743443557 CDOCKER 0.14982896237172177 CHARMm 0.23717217787913342 COMPASS 0.36738882554161917 COMPASS III 0.08996579247434436 COSMObase 0.003990877993158495 COSMOconf 0.004789053591790194 COSMOmic 1.1402508551881414E-4 COSMOperm 0.0013683010262257698 COSMOplex 2.2805017103762827E-4 COSMOquick 0.0015963511972633979 COSMOtherm 0.06636259977194983 Cantera 0.0 Catalyst 0.09771949828962372 Classical Simulations 1.0 Conformers 6.841505131128849E-4 Crystallization 0.07457240592930445 DFTB Plus 0.00604332953249715 DMol3 0.17571265678449258 DPD 0.002622576966932725 Discover 0.0034207525655644243 Forcite 0.5500570125427594 GULP 0.023489167616875712 Kinetix 2.2805017103762827E-4 LUDI 0.0030786773090079817 LibDock 0.062029646522234895 LigandFit 0.0036488027366020524 MCSS 4.5610034207525655E-4 MODELER 0.19828962371721778 MesoDyn 9.122006841505131E-4 Mesocite 0.0033067274800456102 Mesoscale 0.0063854047890535915 Modules 0.0 Morphology 0.01790193842645382 ONETEP 0.0011402508551881414 Polymorph 0.0020524515393386543 QMERA 1.1402508551881414E-4 QSAR 0.0011402508551881414 Quantum Mechanics 0.5611174458380844 Reflex 0.05381984036488027 Reflex Plus 0.0010262257696693272 Semi-empirical 0.007525655644241733 Sorption 0.05826681870011403 Synthia 0.0014823261117445838 TURBOMOLE 5.701254275940707E-4 VAMP 0.0011402508551881414 Visualization 0.7213226909920183 X-Cell 0.0014823261117445838 ZDOCK 0.024629418472063853

Year

2023 0.18301701862247172 2024 0.5319433306602512 2025 1.0 2026 0.37868662567940836 2027 0.0

Keywords

target 1.0 potential 0.2813257456001686 docking 0.19454104752871745 analysis 0.19280219201180315 visualization 0.17019707029191697 between 0.1568658446622405 novel 0.09611128675308252 energy 0.09584782379597429 promising 0.06576035409421435 cell 0.06460111708293814 binding 0.0582780061123406 performance 0.04157445463167879 activity 0.04125829908314891 stability 0.03915059542628307 experimental 0.030509010433133102 interaction 0.024818210559595322 synthesized 0.023764358731162397 effective 0.018495099588997786 including 0.017704710717673097 mechanism 0.016756244072083464 development 0.015807777426493835 enhanced 0.0033196332595637054 synthesis 0.0030561703024554747 protein 0.001264622194119507 design 0.0
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