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Application

Discovery Studio 0.7415374881366656 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.08238636363636363 Amorphous Cell 0.2727272727272727 Blends 0.003787878787878788 CASTEP 0.49573863636363635 CDOCKER 0.13589015151515152 CHARMm 0.22916666666666666 COMPASS 0.4228219696969697 COMPASS III 0.04261363636363636 COSMObase 0.0 COSMOconf 0.0 COSMOmic 4.734848484848485E-4 COSMOperm 0.0014204545454545455 COSMOplex 0.0 COSMOquick 0.0014204545454545455 COSMOtherm 0.061079545454545456 Catalyst 0.08996212121212122 Classical Simulations 1.0 Conformers 0.001893939393939394 Crystallization 0.08948863636363637 DFTB Plus 0.004734848484848485 DMol3 0.23958333333333334 DPD 0.003787878787878788 Discover 0.00615530303030303 Forcite 0.5516098484848485 GULP 0.036931818181818184 Kinetix 0.0 LUDI 0.0033143939393939395 LibDock 0.06013257575757576 LigandFit 0.003787878787878788 MCSS 0.0014204545454545455 MODELER 0.2168560606060606 MesoDyn 0.002840909090909091 Mesocite 0.005208333333333333 Mesoscale 0.010890151515151516 Morphology 0.017045454545454544 ONETEP 0.001893939393939394 Polymorph 9.46969696969697E-4 QMERA 0.0 QSAR 0.0014204545454545455 Quantum Mechanics 0.7206439393939394 Reflex 0.07054924242424243 Semi-empirical 0.008049242424242424 Sorption 0.054450757575757576 Synthia 4.734848484848485E-4 TURBOMOLE 4.734848484848485E-4 VAMP 0.0023674242424242425 Visualization 0.6822916666666666 X-Cell 0.0 ZDOCK 0.02556818181818182

Year

2024 0.0

Keywords

target 1.0 potential 0.25344408427876824 analysis 0.1693679092382496 between 0.1643030794165316 docking 0.1620745542949757 visualization 0.1331037277147488 energy 0.10068881685575365 novel 0.08589951377633712 binding 0.047609400324149106 cell 0.0423419773095624 interaction 0.04092382495948136 promising 0.03322528363047002 stability 0.03180713128038898 experimental 0.031604538087520256 activity 0.025526742301458672 effective 0.023095623987034037 mechanism 0.018233387358184763 synthesized 0.015802269043760128 including 0.008711507293354943 performance 0.006077795786061589 chemical 0.004862236628849271 development 0.004659643435980551 synthesis 0.0030388978930307943 higher 0.0016207455429497568 surface 0.0
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