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Application

Discovery Studio 0.8601525608427171 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06623681125439625 Amorphous Cell 0.18757327080890973 Antibody 0.0035169988276670576 Blends 0.004689331770222743 CASTEP 0.5691676436107854 CDOCKER 0.21219226260257915 CHARMm 0.2596717467760844 COMPASS 0.3862837045720985 COMPASS III 0.0 COSMObase 5.861664712778429E-4 COSMOconf 0.0017584994138335288 COSMOperm 5.861664712778429E-4 COSMOplex 0.0 COSMOquick 0.0035169988276670576 COSMOtherm 0.06506447831184056 Catalyst 0.1025791324736225 Classical Simulations 1.0 Conformers 0.0017584994138335288 Crystallization 0.12778429073856976 DFTB Plus 0.0035169988276670576 DMol3 0.335873388042204 DPD 0.007033997655334115 Discover 0.03634232121922626 Forcite 0.45955451348182885 GULP 0.05275498241500586 LUDI 0.007033997655334115 LibDock 0.06623681125439625 LigandFit 0.02403282532239156 MCSS 0.0017584994138335288 MODELER 0.26436107854630714 MesoDyn 0.004689331770222743 Mesocite 0.0076201641266119575 Mesoscale 0.016412661195779603 Morphology 0.03341148886283705 ONETEP 0.0029308323563892145 Polymorph 0.0011723329425556857 QSAR 0.0011723329425556857 Quantum Mechanics 0.8892145369284877 Reflex 0.09085580304806565 Reflex Plus 0.008206330597889801 Semi-empirical 0.010550996483001172 Sorption 0.053927315357561546 Synthia 0.0011723329425556857 TURBOMOLE 0.0011723329425556857 VAMP 0.005861664712778429 Visualization 0.8411488862837045 X-Cell 0.004689331770222743 ZDOCK 0.032825322391559206

Year

2020 0.0

Keywords

target 1.0 visualization 0.17048832271762207 between 0.16942675159235668 docking 0.1416135881104034 potential 0.13036093418259023 analysis 0.09872611464968153 novel 0.0910828025477707 energy 0.07537154989384288 experimental 0.07176220806794055 activity 0.05859872611464968 binding 0.058174097664543525 interaction 0.055201698513800426 well 0.04394904458598726 chemical 0.037367303609341825 synthesized 0.035668789808917196 cell 0.02929936305732484 surface 0.024840764331210193 protein 0.02186836518046709 mechanism 0.01889596602972399 design 0.013588110403397028 synthesis 0.008067940552016985 promising 0.0074309978768577496 higher 0.007218683651804671 inhibition 0.0031847133757961785 compound 0.0
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